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  • 1
    Publication Date: 2023-11-30
    Description: This data includes the dissolved organic matter (DOM) molecular composition data obtained via Fourier-transform ion cyclotron resonance mass spectrometry and the accompanying metadata (cruise, station number, geographic coordinates, water depth, temperature, salinity and solid-phase extracted dissolved organic carbon concentrations (SPE-DOC)) for multiple oceanographic cruises (HOTS, BATS, SO254, SO245, SO248, ANT 28-II, ANT 28-IV, and 28-V). This data was analyzed in Bercovici et al., 2023 (https://doi.org/10.1029/2023GB007740). DOM composition data for the cruise SO245 was previously published in Osterholz et al., 2021 (https://doi.org/10.1016/j.marchem.2021.103955). In order to maximize comparability among data, we reanalyzed the same set of samples from SO245 on the FT-ICR-MS together with the samples from the other cruises and sites. SPE-DOC concentrations were determined on a Shimadzu TOC-VPCH total organic carbon analyzer. DOM composition was determined on a SolariX XR FT-ICR-MS (Bruker Daltonik GmbH, Bremen, Germany) equipped with a 15 Tesla superconducting magnet and an electrospray ionization source (ESI; Bruker Apollo II ion source). The metadata were compiled from the CTD bottle data of multiple cruises, some of which are available on PANGAEA at the following links: SO248: https://doi.org/10.1594/PANGAEA.864673, SO245: https://doi.org/10.1594/PANGAEA.890394, SO254: https://doi.org/10.1594/PANGAEA.890453.
    Keywords: Dissolved Organic Matter; Fourier-transform ion cyclotron mass spectrometry; Global Ocean; molecular composition
    Type: Dataset
    Format: application/zip, 2 datasets
    Location Call Number Limitation Availability
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  • 2
    Publication Date: 2024-02-02
    Description: The data presented here include the metadata (cruise, station number, geographic coordinates, water depth, temperature, salinity and solid-phase extracted dissolved organic carbon concentrations (SPE-DOC)) for multiple oceanographic cruises in the Atlantic, Pacific and Southern oceans (HOTS, BATS, SO254, SO245, SO248, ANT 28-II, ANT 28-IV, and 28-V) between 2009 and 2017. These metadata were used in conjunction with the accompanying dataset to assess the role of deep ocean mixing in the molecular composition of dissolved organic matter was compiled from the CTD bottle data of multiple cruises, some of which are available on PANGAEA at the following links: SO248: https://doi.org/10.1594/PANGAEA.864673, SO245: https://doi.org/10.1594/PANGAEA.890394, SO254: https://doi.org/10.1594/PANGAEA.890453.
    Keywords: ANT-XXVIII/2; ANT-XXVIII/4; ANT-XXVIII/5; BacGeoPac; BAT_SPE; Bering Sea; Canarias Sea; Carbon, organic, dissolved, extracted; Central Pacific Ocean; Cruise/expedition; CTD/Rosette; CTD-RO; Date/Time of event; DEPTH, water; Dissolved Organic Matter; Drake Passage; Equatorial Pacific; Event label; Fourier-transform ion cyclotron mass spectrometry; Global Ocean; HOT_SPE; LATITUDE; Lazarev Sea; Location; LONGITUDE; molecular composition; MUC; MultiCorer; North Atlantic Ocean; North Pacific Ocean; Polarstern; Pori Bac NewZ; PS79; PS79/035-3; PS79/036-1; PS79/037-1; PS79/038-2; PS79/039-3; PS79/040-2; PS79/041-3; PS79/042-2; PS79/043-2; PS79/044-1; PS79/045-1; PS79/046-3; PS79/048-1; PS79/049-2; PS79/052-2; PS79/053-3; PS79/054-3; PS79/178-1; PS79/179-1; PS79/193-2; PS79/205-1; PS79/217-1; PS79/232-1; PS79/235-3; PS79/241-3; PS79/244-2; PS79/247-1; PS79/251-1; PS79/262-3; PS79/267-1; PS79/277-2; PS79/281-1; PS79/287-2; PS79/296-3; PS79/297-3; PS79/298-3; PS79/300-4; PS79/301-3; PS79/302-4; PS79/304-2; PS79/306-2; PS79/307-4; PS79/308-2; PS79/310-4; PS79/311-2; PS79/312-4; PS79/313-4; PS79/314-4; PS79/315-4; PS79/317-4; PS79/318-4; PS79/319-4; PS79/320-3; PS79/321-4; PS79/322-4; PS79/323-2; PS79/324-4; PS79/328-3; PS79/329-4; Salinity; Sample ID; Sample number; Scotia Sea; SO245; SO245_10-1; SO245_1-1; SO245_11-1; SO245_12-2; SO245_13-1; SO245_14-2; SO245_15-2; SO245_2-2; SO245_3-1; SO245_4-1; SO245_5-1; SO245_6-1; SO245_7-4; SO245_8-1; SO245_9-1; SO248; SO248_10-2a; SO248_10-2b; SO248_1-1; SO248_11-1; SO248_12-1; SO248_12-3; SO248_13-3; SO248_14-3; SO248_14-7; SO248_15-1; SO248_16-10; SO248_16-13; SO248_16-15; SO248_16-2; SO248_16-3; SO248_16-5; SO248_17-4; SO248_18-3; SO248_18-5; SO248_19-1; SO248_19-2; SO248_2-1; SO248_2-4; SO248_3-1; SO248_4-1; SO248_4-3; SO248_5-1; SO248_6-1; SO248_6-10; SO248_6-11; SO248_6-13; SO248_6-2; SO248_6-4; SO248_6-5; SO248_7-1; SO248_7-4; SO248_8-2; SO248_8-4; SO248_9-3; SO254; SO254_23-1; SO254_32-1; SO254_38-1; SO254_45-1; SO254_47-1; SO254_59-1; SO254_65-1; Sonne_2; South Atlantic Ocean; South Pacific Ocean; Station label; Temperature, water; Total organic carbon analyzer (TOC), Shimadzu, TOC-VPCH; UltraPac, GEOTRACES; Vessel; Weddell Sea; Year of sampling
    Type: Dataset
    Format: text/tab-separated-values, 11028 data points
    Location Call Number Limitation Availability
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  • 3
    Publication Date: 2024-02-02
    Description: This data includes the dissolved organic matter (DOM) molecular composition data obtained via Fourier-transform ion cyclotron resonance mass spectrometry for multiple oceanographic cruises collected in the Atlantic, Pacific and Southern oceans (HOTS, BATS, SO254, SO245, SO248, ANT 28-II, ANT 28-IV, and 28-V) between 2009 and 2017. This analysis was conducted to assess the molecular composition of DOM in the context of ocean mixing. DOM was extracted and desalted using the solid phase extraction method as described in Dittmar et al. 2008. The extracts were stored frozen in methanol until analysis in 2019, when aliquots of the extracts were mixed with 50% ultrapure water (50:50 v/v) and diluted to a final carbon concentration of 2.5 ppm. DOM composition was determined on a SolariX XR FT-ICR-MS (Bruker Daltonik GmbH, Bremen, Germany) equipped with a 15 Tesla superconducting magnet and an electrospray ionization source (ESI; Bruker Apollo II ion source) in negative ion mode, as described in (Bercovici, Dittmar, and Niggemann 2022). Subsequent data processing and molecular formula assignment was conducted in ICBM-OCEAN, as described in (Merder et al. 2020).
    Keywords: ANT-XXVIII/2; ANT-XXVIII/4; ANT-XXVIII/5; BacGeoPac; BAT_SPE; Bering Sea; Canarias Sea; Central Pacific Ocean; CTD/Rosette; CTD-RO; Dissolved Organic Matter; Drake Passage; Equatorial Pacific; Fourier-transform ion cyclotron mass spectrometry; Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix); Global Ocean; HOT_SPE; Lazarev Sea; Mass of molecular formulas; molecular composition; Molecular formula; MUC; MultiCorer; North Atlantic Ocean; North Pacific Ocean; Peak intensity; Polarstern; Pori Bac NewZ; PS79; PS79/035-3; PS79/036-1; PS79/037-1; PS79/038-2; PS79/039-3; PS79/040-2; PS79/041-3; PS79/042-2; PS79/043-2; PS79/044-1; PS79/045-1; PS79/046-3; PS79/048-1; PS79/049-2; PS79/052-2; PS79/053-3; PS79/054-3; PS79/178-1; PS79/179-1; PS79/193-2; PS79/205-1; PS79/217-1; PS79/232-1; PS79/235-3; PS79/241-3; PS79/244-2; PS79/247-1; PS79/251-1; PS79/262-3; PS79/267-1; PS79/277-2; PS79/281-1; PS79/287-2; PS79/296-3; PS79/297-3; PS79/298-3; PS79/300-4; PS79/301-3; PS79/302-4; PS79/304-2; PS79/306-2; PS79/307-4; PS79/308-2; PS79/310-4; PS79/311-2; PS79/312-4; PS79/313-4; PS79/314-4; PS79/315-4; PS79/317-4; PS79/318-4; PS79/319-4; PS79/320-3; PS79/321-4; PS79/322-4; PS79/323-2; PS79/324-4; PS79/328-3; PS79/329-4; Scotia Sea; SO245; SO245_10-1; SO245_1-1; SO245_11-1; SO245_12-2; SO245_13-1; SO245_14-2; SO245_15-2; SO245_2-2; SO245_3-1; SO245_4-1; SO245_5-1; SO245_6-1; SO245_7-4; SO245_8-1; SO245_9-1; SO248; SO248_10-2a; SO248_10-2b; SO248_1-1; SO248_11-1; SO248_12-1; SO248_12-3; SO248_13-3; SO248_14-3; SO248_14-7; SO248_15-1; SO248_16-10; SO248_16-13; SO248_16-15; SO248_16-2; SO248_16-3; SO248_16-5; SO248_17-4; SO248_18-3; SO248_18-5; SO248_19-1; SO248_19-2; SO248_2-1; SO248_2-4; SO248_3-1; SO248_4-1; SO248_4-3; SO248_5-1; SO248_6-1; SO248_6-10; SO248_6-11; SO248_6-13; SO248_6-2; SO248_6-4; SO248_6-5; SO248_7-1; SO248_7-4; SO248_8-2; SO248_8-4; SO248_9-3; SO254; SO254_23-1; SO254_32-1; SO254_38-1; SO254_45-1; SO254_47-1; SO254_59-1; SO254_65-1; Sonne_2; South Atlantic Ocean; South Pacific Ocean; UltraPac, GEOTRACES; Weddell Sea
    Type: Dataset
    Format: text/tab-separated-values, 6762084 data points
    Location Call Number Limitation Availability
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