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1-(1'-Hydroxy-1',5'-dimethylhex-5'-enyl)-4-methylcyclohex-3-ene-1-carboxylic acid

View entire compound with spectra: 1 MS (GC)

1-(1'-Hydroxy-1',5'-dimethylhex-5'-enyl)-4-methylcyclohex-3-ene-1-carboxylic acid
SpectraBase Compound ID BgR5f8zHs5N
InChI InChI=1S/C16H26O3/c1-12(2)6-5-9-15(4,19)16(14(17)18)10-7-13(3)8-11-16/h7,19H,1,5-6,8-11H2,2-4H3,(H,17,18)
InChIKey PUYYCGTXTQJWIX-UHFFFAOYSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 680rO2fxrv8
Name 1-(1'-Hydroxy-1',5'-dimethylhex-5'-enyl)-4-methylcyclohex-3-ene-1-carboxylic acid
Alternate Name(s) 1-(1-hydroxy-1,5-dimethyl-5-hexenyl)-4-methyl-3-cyclohexene-1-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-12(2)6-5-9-15(4,19)16(14(17)18)10-7-13(3)8-11-16/h7,19H,1,5-6,8-11H2,2-4H3,(H,17,18)
InChIKey PUYYCGTXTQJWIX-UHFFFAOYSA-N
Molecular Weight 266.381 g/mol
SMILES OC(C1(C(O)(CCCC(=C)C)C)CC=C(CC1)C)=O
SPLASH splash10-014i-0190000000-7abe5d46c2b8f644f124
Source of Spectrum H-86-2706-16
Wiley ID 1525612