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1-Cyclohexene-1-acetic acid
SpectraBase Compound ID GrbJqKv4Nre
InChI InChI=1S/C8H12O2/c9-8(10)6-7-4-2-1-3-5-7/h4H,1-3,5-6H2,(H,9,10)
InChIKey KDFBPHXESBPHTK-UHFFFAOYSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GeCPNyhcEXC
Name 1-Cyclohexen-1-ylacetic acid
CAS Registry Number 18294-87-6
Comments Less than 3 mono-isotopic peaks
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Formula C8H12O2
InChI InChI=1S/C8H12O2/c9-8(10)6-7-4-2-1-3-5-7/h4H,1-3,5-6H2,(H,9,10)
InChIKey KDFBPHXESBPHTK-UHFFFAOYSA-N
Molecular Weight 140.182 g/mol
SMILES OC(CC1=CCCCC1)=O
SPLASH splash10-001i-9100000000-f617afb283a3a3942f91
Source of Spectrum F-57-9695-9
Synonyms 1-Cyclohexene-1-acetic acid 2-(1-cyclohexenyl)acetic acid 2-(cyclohexen-1-yl)acetic acid 2-(cyclohexen-1-yl)ethanoic acid
Wiley ID 1626493