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(4Z)-5-(3-Methylphenyl)-4-pentenoic Acid
SpectraBase Compound ID 76ndYwueHQ6
InChI InChI=1S/C12H14O2/c1-10-5-4-7-11(9-10)6-2-3-8-12(13)14/h2,4-7,9H,3,8H2,1H3,(H,13,14)/b6-2-
InChIKey JAZAKRAXKUTXSG-KXFIGUGUSA-N
Mol Weight 190.24 g/mol
Molecular Formula C12H14O2
Exact Mass 190.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQSmgR82Kgs
Name (4Z)-5-(3-Methylphenyl)-4-pentenoic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O2
InChI InChI=1S/C12H14O2/c1-10-5-4-7-11(9-10)6-2-3-8-12(13)14/h2,4-7,9H,3,8H2,1H3,(H,13,14)/b6-2-
InChIKey JAZAKRAXKUTXSG-KXFIGUGUSA-N
Literature Reference DOI 10.1021/ol203033k
Molecular Weight 190.242 g/mol
SMILES OC(CC\C=C/c1cc(ccc1)C)=O
SPLASH splash10-001l-0900000000-d50a721f4e7485688c5d
Source of Spectrum A1-14-256/SMS35-6g
Synonyms (Z)-5-(m-tolyl)pent-4-enoic acid
Wiley ID 1749985