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Bensulide
SpectraBase Compound ID B3IDHpLXRvD
InChI InChI=1S/C14H24NO4PS3/c1-12(2)18-20(21,19-13(3)4)22-11-10-15-23(16,17)14-8-6-5-7-9-14/h5-9,12-13,15H,10-11H2,1-4H3
InChIKey RRNIZKPFKNDSRS-UHFFFAOYSA-N
Mol Weight 397.5 g/mol
Molecular Formula C14H24NO4PS3
Exact Mass 397.060509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ITvzNfgbYG
Name Bensulide
CAS Registry Number 741-58-2
Classification Herbicide
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 397.060508773 u
Formula C14H24NO4PS3
InChI InChI=1S/C14H24NO4PS3/c1-12(2)18-20(21,19-13(3)4)22-11-10-15-23(16,17)14-8-6-5-7-9-14/h5-9,12-13,15H,10-11H2,1-4H3
InChIKey RRNIZKPFKNDSRS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 397.503 g/mol
Nominal Mass 397 u
Quality 996
Retention Index 2728
SMILES C=1(S(NCCSP(OC(C)C)(OC(C)C)=S)(=O)=O)C=CC=CC1
SPLASH splash10-00bc-7900000000-4128445637f60df6bc6a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms O,O-Di-iso-propyl-S-2-phenylsulfonylaminoethylphosphorodithioate
Technique GC/MS
Wiley ID DD2024_012099