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(Z)-4-Methyl-3-hexenoic acid
SpectraBase Compound ID 1hZHJMmwx6p
InChI InChI=1S/C7H12O2/c1-3-6(2)4-5-7(8)9/h4H,3,5H2,1-2H3,(H,8,9)/b6-4-
InChIKey VKWJULLMBKNPEC-XQRVVYSFSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LN6kI90Xr9U
Name (Z)-4-Methyl-3-hexenoic acid
Classification Medium-chain fatty acids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 128.083729624 u
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-3-6(2)4-5-7(8)9/h4H,3,5H2,1-2H3,(H,8,9)/b6-4-
InChIKey VKWJULLMBKNPEC-XQRVVYSFSA-N
Molecular Weight 128.171 g/mol
Number of Peaks 23
SMILES OC(C\C=C/(CC)C)=O
SPLASH splash10-069u-9100000000-256d559ae6ebc734ec38
Source of Spectrum FF-28-64-63_4 (DOI: 10.1002/ffj.3128)
Synonyms (Z)-4-methylhex-3-enoic acid
Wiley ID 1775616