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(+/-)-5-(trans-4'-hydroxy-4'-methyl-rel-1'-cyclohexyl)hexanal
SpectraBase Compound ID J9ut2V9HKna
InChI InChI=1S/C13H24O2/c1-11(5-3-4-10-14)12-6-8-13(2,15)9-7-12/h10-12,15H,3-9H2,1-2H3/t11?,12-,13-
InChIKey KRVOPQWGTAECLI-VLXSWZPNSA-N
Mol Weight 212.33 g/mol
Molecular Formula C13H24O2
Exact Mass 212.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWEarJawaes
Name (+/-)-5-(trans-4'-hydroxy-4'-methyl-rel-1'-cyclohexyl)hexanal
Alternate Name(s) (S)-5-((1r,4S)-4-hydroxy-4-methylcyclohexyl)hexanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O2
InChI InChI=1S/C13H24O2/c1-11(5-3-4-10-14)12-6-8-13(2,15)9-7-12/h10-12,15H,3-9H2,1-2H3/t11?,12-,13-
InChIKey KRVOPQWGTAECLI-VLXSWZPNSA-N
Literature Reference DOI 10.1002/hlca.19800630109
Molecular Weight 212.333 g/mol
SMILES O[C@]1(CC[C@@](CC1)(C(C)CCCC=O)[H])C
SPLASH splash10-00dl-9000000000-26f2f5955a4ca917d19e
Source of Spectrum H-63-92-30
Wiley ID 1797428