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 Google Search
Mol Weight	210.32 g/mol
Molecular Formula	C13H22O2
Exact Mass	210.16198 g/mol

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SpectraBase Spectrum ID	HZZa57mOyIx
Name	Butanoic acid, 4-[4-(1-methylethyl)cyclohexylidene]-
Alternate Name(s)	4-(4'-Isopropyl)cyclohexylidenebutyric acid 4-(4-isopropylcyclohexylidene)butanoic acid
CAS Registry Number	59177-17-2
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
Wiley ID	1209510