Dataset

Trichloronat

This MassBank record with Accession MSBNK-Eawag-EQ01141106 contains the MS2 mass spectrum of Trichloronat with the InChIkey ANIAQSUBRGXWLS-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H12Cl3O2PS/c1-3-14-16(17,4-2)15-10-6-8(12)7(11)5-9(10)13/h5-6H,3-4H2,1-2H3
SMILES CCOP(=S)(CC)OC1=CC(=C(C=C1Cl)Cl)Cl
InChI Key ANIAQSUBRGXWLS-UHFFFAOYSA-N
Molecular Formula C10H12Cl3O2PS
Exact Mass 331.936 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01141106
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MetadataCreated 2024-01-11T14:39:10.924147
MetadataModified 2025-02-09T09:27:06.939675
MetadataPublished 2023-04-27
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