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Butanoic acid, 4-[4-(1-methylethyl)cyclohexylidene]-
SpectraBase Compound ID 4XGKB7BPTui
InChI InChI=1S/C13H22O2/c1-10(2)12-8-6-11(7-9-12)4-3-5-13(14)15/h4,10,12H,3,5-9H2,1-2H3,(H,14,15)/b11-4-
InChIKey TVSQXSCVGIEHAS-WCIBSUBMSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZZa57mOyIx
Name Butanoic acid, 4-[4-(1-methylethyl)cyclohexylidene]-
CAS Registry Number 59177-17-2
Comments Less than 3 mono-isotopic peaks
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Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-10(2)12-8-6-11(7-9-12)4-3-5-13(14)15/h4,10,12H,3,5-9H2,1-2H3,(H,14,15)/b11-4-
InChIKey TVSQXSCVGIEHAS-WCIBSUBMSA-N
Molecular Weight 210.317 g/mol
SMILES OC(CCC=C1CCC(CC1)C(C)C)=O
SPLASH splash10-0006-9020000000-64b9468062ac55d08582
Source of Spectrum B-28-2675-0
Synonyms 4-(4'-Isopropyl)cyclohexylidenebutyric acid 4-(4-isopropylcyclohexylidene)butanoic acid
Wiley ID 1209510