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5-Methoxy-2,2,6-trimethylcyclohexan-1-carboxylic acid
SpectraBase Compound ID 5I0jlkh1Hbr
InChI InChI=1S/C11H18O3/c1-7-8(14-4)5-6-11(2,3)9(7)10(12)13/h8H,5-6H2,1-4H3,(H,12,13)
InChIKey ZFFGJCMZUCIDPF-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KvfYybTWk9
Name 5-Methoxy-2,2,6-trimethylcyclohexan-1-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-7-8(14-4)5-6-11(2,3)9(7)10(12)13/h8H,5-6H2,1-4H3,(H,12,13)
InChIKey ZFFGJCMZUCIDPF-UHFFFAOYSA-N
Molecular Weight 198.262 g/mol
SMILES OC(C1=C(C(OC)CCC1(C)C)C)=O
SPLASH splash10-001j-0900000000-10b68e318412743559da
Source of Spectrum E1-44-46-11
Synonyms 3-methoxy-2,6,6-trimethyl-1-cyclohexene-1-carboxylic acid
Wiley ID 1553257