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2-Methylthio-4-nonenoic acid

View entire compound with spectra: 1 MS (GC)

2-Methylthio-4-nonenoic acid
SpectraBase Compound ID EvJERQ5eOAk
InChI InChI=1S/C10H18O2S/c1-3-4-5-6-7-8-9(13-2)10(11)12/h6-7,9H,3-5,8H2,1-2H3,(H,11,12)/b7-6+
InChIKey GBGYVJZSBAISPO-VOTSOKGWSA-N
Mol Weight 202.31 g/mol
Molecular Formula C10H18O2S
Exact Mass 202.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8t6po8aQWDo
Name 2-Methylthio-4-nonenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2S
InChI InChI=1S/C10H18O2S/c1-3-4-5-6-7-8-9(13-2)10(11)12/h6-7,9H,3-5,8H2,1-2H3,(H,11,12)/b7-6+
InChIKey GBGYVJZSBAISPO-VOTSOKGWSA-N
Molecular Weight 202.312 g/mol
SMILES OC(=O)C(SC)C\C=C\CCCC
SPLASH splash10-0a4i-9130000000-3cecaaf505385915e963
Source of Spectrum QA-45-160-3
Synonyms (4E)-2-(methylsulfanyl)-4-nonenoic acid
Wiley ID 862741