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Cycloheptanepropanol, 1-hydroxy-2,7-dimethyl-, (1.alpha.,2.alpha.,7.alpha.)-
SpectraBase Compound ID 3PxyhcMWsWg
InChI InChI=1S/C12H24O2/c1-10-6-3-4-7-11(2)12(10,14)8-5-9-13/h10-11,13-14H,3-9H2,1-2H3/t10-,11+,12?
InChIKey MLCBPLPFUTXJBO-FOSCPWQOSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kc4tSil93yy
Name Cycloheptanepropanol, 1-hydroxy-2,7-dimethyl-, (1.alpha.,2.alpha.,7.alpha.)-
CAS Registry Number 117405-89-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-10-6-3-4-7-11(2)12(10,14)8-5-9-13/h10-11,13-14H,3-9H2,1-2H3/t10-,11+,12?
InChIKey MLCBPLPFUTXJBO-FOSCPWQOSA-N
Molecular Weight 200.322 g/mol
SMILES OC1(CCCO)[C@](C)(CCCC[C@@]1(C)[H])[H]
SPLASH splash10-03xs-6900000000-f20373e7720f3ca7cea7
Source of Spectrum F-43-5293-11
Synonyms (2R,7S)-1-(3-hydroxypropyl)-2,7-dimethyl-1-cycloheptanol (2R,7S)-1-(3-hydroxypropyl)-2,7-dimethyl-cycloheptanol (2R,7S)-1-(3-hydroxypropyl)-2,7-dimethylcycloheptan-1-ol (2R,7S)-2,7-dimethyl-1-(3-oxidanylpropyl)cycloheptan-1-ol cis-2,7-dimethyl-1-(3-hydroxypropyl)-1-cycloheptanol (2S,7R)-1-(3-hydroxypropyl)-2,7-dimethyl-1-cycloheptanol (2S,7R)-1-(3-hydroxypropyl)-2,7-dimethylcycloheptan-1-ol (2S,7R)-2,7-dimethyl-1-(3-oxidanylpropyl)cycloheptan-1-ol
Wiley ID 1198046