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(1S,2S,3S)-1-cyclohexyl-2-methyl-3-phenyl-propane-1,3-diol

View entire compound with spectra: 1 MS (GC)

(1S,2S,3S)-1-cyclohexyl-2-methyl-3-phenyl-propane-1,3-diol
SpectraBase Compound ID 7UYFwjKpVG9
InChI InChI=1S/C16H24O2/c1-12(15(17)13-8-4-2-5-9-13)16(18)14-10-6-3-7-11-14/h2,4-5,8-9,12,14-18H,3,6-7,10-11H2,1H3/t12-,15+,16-/m1/s1
InChIKey VKRQCUFLQPZRMC-UHOFOFEASA-N
Mol Weight 248.37 g/mol
Molecular Formula C16H24O2
Exact Mass 248.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B18adrLSvIm
Name (1S,2S,3S)-1-cyclohexyl-2-methyl-3-phenyl-propane-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O2
InChI InChI=1S/C16H24O2/c1-12(15(17)13-8-4-2-5-9-13)16(18)14-10-6-3-7-11-14/h2,4-5,8-9,12,14-18H,3,6-7,10-11H2,1H3/t12-,15+,16-/m1/s1
InChIKey VKRQCUFLQPZRMC-UHOFOFEASA-N
Molecular Weight 248.366 g/mol
SMILES O[C@@]([C@]([C@](C1CCCCC1)(O)[H])(C)[H])(c1ccccc1)[H]
SPLASH splash10-014l-8900000000-0d947d9d6a8e0501ae25
Source of Spectrum KC-0-718-31
Wiley ID 830119