Dataset

Furathiocarb; LC-ESI-QQ; MS2; CE:30 V; [M+H]+

This MassBank record with Accession MSBNK-Waters-WA000143 contains the MS2 mass spectrum of Furathiocarb with the InChIkey HAWJXYBZNNRMNO-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C18H26N2O5S/c1-6-7-11-23-16(21)19(4)26-20(5)17(22)24-14-10-8-9-13-12-18(2,3)25-15(13)14/h8-10H,6-7,11-12H2,1-5H3
SMILES CCCCOC(=O)N(C)SN(C)C(=O)Oc(c2)c(O1)c(cc2)CC(C)(C)1
InChI Key HAWJXYBZNNRMNO-UHFFFAOYSA-N
Molecular Formula C18H26N2O5S
Exact Mass 382.156 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000143
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • (2,2-dimethyl-3H-1-benzofuran-7-yl) N-[butoxycarbonyl(methyl)amino]sulfanyl-N-methylcarbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J21.613E Nikkaji
    HMDB0252533 Human Metabolome Database
    CB9189847 ChemicalBook
    DTXSID3052725 EPA CompTox Dashboard
    C18650 KEGG Ligand
    CHEMBL1551453 ChEMBL
    38504 ChEBI
    509921 eMolecules
    65907-30-4 ACToR
    14878053 PubChem: Thomson Pharma
    WZI2IZ80UY FDA SRS
    ZINC000005514002 ZINC
    47759 PubChem
    SCHEMBL26806 SureChEMBL
    The data in this table is sourced from UniChem at EBI.