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2-(Methylthio)-4-heptenoic isobutyl amide
SpectraBase Compound ID IhmzoHjb9zQ
InChI InChI=1S/C12H23NOS/c1-5-6-7-8-11(15-4)12(14)13-9-10(2)3/h6-7,10-11H,5,8-9H2,1-4H3,(H,13,14)/b7-6+
InChIKey MAWAINRRYZRCOJ-VOTSOKGWSA-N
Mol Weight 229.38 g/mol
Molecular Formula C12H23NOS
Exact Mass 229.150036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HC7QrueEMi
Name 2-(Methylthio)-4-heptenoic isobutyl amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H23NOS
InChI InChI=1S/C12H23NOS/c1-5-6-7-8-11(15-4)12(14)13-9-10(2)3/h6-7,10-11H,5,8-9H2,1-4H3,(H,13,14)/b7-6+
InChIKey MAWAINRRYZRCOJ-VOTSOKGWSA-N
Molecular Weight 229.382 g/mol
SMILES N(C(=O)C(SC)C\C=C\CC)CC(C)C
SPLASH splash10-001i-4900000000-342699ddbefbe77d9384
Source of Spectrum QA-46-964-3
Synonyms (4E)-N-isobutyl-2-(methylsulfanyl)-4-heptenamide
Wiley ID 863187