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3-[4'-(t-Butyl)cyclohex-1'-en-1'-yl]-propanoic acid
SpectraBase Compound ID 2ikMG1WY7wp
InChI InChI=1S/C13H22O2/c1-13(2,3)11-7-4-10(5-8-11)6-9-12(14)15/h4,11H,5-9H2,1-3H3,(H,14,15)
InChIKey JZGOBICJJKMTAR-UHFFFAOYSA-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 GgHEqKyh8jV
Name 3-[4'-(t-Butyl)cyclohex-1'-en-1'-yl]-propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-13(2,3)11-7-4-10(5-8-11)6-9-12(14)15/h4,11H,5-9H2,1-3H3,(H,14,15)
InChIKey JZGOBICJJKMTAR-UHFFFAOYSA-N
Molecular Weight 210.317 g/mol
SMILES OC(CCC1=CCC(C(C)(C)C)CC1)=O
SPLASH splash10-0a4u-9500000000-7e08d50845b590367326
Source of Spectrum H-87-1703-3
Synonyms 3-(4-tert-butyl-1-cyclohexen-1-yl)propanoic acid
Wiley ID 1563900