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(E)-2-(methylthio)-4-nonenoic acid methyl ester
SpectraBase Compound ID AafkpPMsIuK
InChI InChI=1S/C11H20O2S/c1-4-5-6-7-8-9-10(14-3)11(12)13-2/h7-8,10H,4-6,9H2,1-3H3/b8-7+
InChIKey UFYDEWPNBCQACU-BQYQJAHWSA-N
Mol Weight 216.34 g/mol
Molecular Formula C11H20O2S
Exact Mass 216.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jv98vmsW17
Name (E)-2-(methylthio)-4-nonenoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2S
InChI InChI=1S/C11H20O2S/c1-4-5-6-7-8-9-10(14-3)11(12)13-2/h7-8,10H,4-6,9H2,1-3H3/b8-7+
InChIKey UFYDEWPNBCQACU-BQYQJAHWSA-N
Molecular Weight 216.339 g/mol
SMILES C(=O)(C(SC)C\C=C\CCCC)OC
SPLASH splash10-0a4i-9000000000-01b0b63b130b397f6e06
Source of Spectrum QA-44-496-3
Synonyms (E)-2-(methylthio)non-4-enoic acid methyl ester Methyl (4E)-2-(methylsulfanyl)-4-nonenoate Methyl (E)-2-methylsulfanylnon-4-enoate
Wiley ID 862652