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6-Hydroxy-3,7-dimethyl-7-(4-hydroxymethyl-4-hydroxypentyl)-2-cycloheptene
SpectraBase Compound ID CPCPrSF42BE
InChI InChI=1S/C15H28O3/c1-12-5-6-13(17)14(2,10-7-12)8-4-9-15(3,18)11-16/h7,13,16-18H,4-6,8-11H2,1-3H3/t13?,14-,15?/m1/s1
InChIKey DCAQKZHSRHDEQB-SHARSMKWSA-N
Mol Weight 256.39 g/mol
Molecular Formula C15H28O3
Exact Mass 256.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXVukE8M9Zt
Name 6-Hydroxy-3,7-dimethyl-7-(4-hydroxymethyl-4-hydroxypentyl)-2-cycloheptene
Alternate Name(s) 5-((R)-7-Hydroxy-1,4-dimethyl-cyclohept-3-enyl)-2-methyl-pentane-1,2-diol 5-(7-hydroxy-1,4-dimethyl-3-cyclohepten-1-yl)-2-methyl-1,2-pentanediol 5-[(1R)-7-hydroxy-1,4-dimethyl-1-cyclohept-3-enyl]-2-methylpentane-1,2-diol 5-[(1R)-7-hydroxy-1,4-dimethylcyclohept-3-en-1-yl]-2-methylpentane-1,2-diol 5-[(1R)-1,4-dimethyl-7-oxidanyl-cyclohept-3-en-1-yl]-2-methyl-pentane-1,2-diol
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Formula C15H28O3
InChI InChI=1S/C15H28O3/c1-12-5-6-13(17)14(2,10-7-12)8-4-9-15(3,18)11-16/h7,13,16-18H,4-6,8-11H2,1-3H3/t13?,14-,15?/m1/s1
InChIKey DCAQKZHSRHDEQB-SHARSMKWSA-N
Molecular Weight 256.386 g/mol
SMILES OC1CCC(=CC[C@]1(CCCC(CO)(O)C)C)C
SPLASH splash10-05us-9600000000-f336d9413358b42cd172
Source of Spectrum F-50-12669-25
Wiley ID 789961