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(1S,2S,5R)-1-(3,3-dimethylbutyl)-2-isopropyl-5-methyl-cyclohexanol
SpectraBase Compound ID AI9tuKLbGQX
InChI InChI=1S/C16H32O/c1-12(2)14-8-7-13(3)11-16(14,17)10-9-15(4,5)6/h12-14,17H,7-11H2,1-6H3/t13-,14+,16+/m1/s1
InChIKey ZPDDOCYCUPPLCW-YCPHGPKFSA-N
Mol Weight 240.4 g/mol
Molecular Formula C16H32O
Exact Mass 240.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5iNyxtJI2jC
Name (1S,2S,5R)-1-(3,3-dimethylbutyl)-2-isopropyl-5-methyl-cyclohexanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H32O
InChI InChI=1S/C16H32O/c1-12(2)14-8-7-13(3)11-16(14,17)10-9-15(4,5)6/h12-14,17H,7-11H2,1-6H3/t13-,14+,16+/m1/s1
InChIKey ZPDDOCYCUPPLCW-YCPHGPKFSA-N
Molecular Weight 240.431 g/mol
SMILES O[C@@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])CCC(C)(C)C
SPLASH splash10-0a4i-9700000000-bd906a6df01a5d9ed70d
Source of Spectrum QC-11-1525-20
Synonyms (1S,2S,5R)-1-(3,3-dimethylbutyl)-5-methyl-2-propan-2-yl-1-cyclohexanol (1S,2S,5R)-1-(3,3-dimethylbutyl)-5-methyl-2-propan-2-yl-cyclohexan-1-ol
Wiley ID 859771