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2-Methylpropanethioic acid S-(allylthio) ester
SpectraBase Compound ID CinQdQrwiH1
InChI InChI=1S/C7H12OS2/c1-4-5-9-10-7(8)6(2)3/h4,6H,1,5H2,2-3H3
InChIKey HHFZRVFNTRLYAF-UHFFFAOYSA-N
Mol Weight 176.29 g/mol
Molecular Formula C7H12OS2
Exact Mass 176.032957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Syy7fslkW
Name 2-Methylpropanethioic acid S-(allylthio) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12OS2
InChI InChI=1S/C7H12OS2/c1-4-5-9-10-7(8)6(2)3/h4,6H,1,5H2,2-3H3
InChIKey HHFZRVFNTRLYAF-UHFFFAOYSA-N
Molecular Weight 176.292 g/mol
SMILES C(=O)(SSCC=C)C(C)C
SPLASH splash10-0006-9000000000-e4727b631680ae770f5f
Source of Spectrum SO-0-762-1
Synonyms 2-Methylpropanethioic acid S-(prop-2-enylthio) ester S-allylsulfanyl 2-methylpropanethioate S-prop-2-enylsulfanyl 2-methylpropanethioate
Wiley ID 1545051