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2-Methyl-4-pentenoic acid
SpectraBase Compound ID Ix2s8UXqD4T
InChI InChI=1S/C6H10O2/c1-3-4-5(2)6(7)8/h3,5H,1,4H2,2H3,(H,7,8)
InChIKey HVRZYSHVZOELOH-UHFFFAOYSA-N
Mol Weight 114.14 g/mol
Molecular Formula C6H10O2
Exact Mass 114.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RElRCdNhxb
Name 2-Methyl-4-pentenoic acid
CAS Registry Number 1575-74-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C6H10O2/c1-3-4-5(2)6(7)8/h3,5H,1,4H2,2H3,(H,7,8)
InChIKey HVRZYSHVZOELOH-UHFFFAOYSA-N
Molecular Weight 114.144 g/mol
SMILES OC(=O)C(C)CC=C
SPLASH splash10-00kf-9000000000-e7f178b1d065badb2c5f
Source ex BEDOUKIAN ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Pentenoic acid<2-methyl-4->
Wiley ID 1887772