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(+/-)-3-(trans-4'-hydroxy-4'-methyl-rel-1'-cyclohexyl)butanal
SpectraBase Compound ID 4wbrOlpdTQj
InChI InChI=1S/C11H20O2/c1-9(5-8-12)10-3-6-11(2,13)7-4-10/h8-10,13H,3-7H2,1-2H3/t9?,10-,11-
InChIKey JBFNGHDRDZVHBO-JQTAXMAWSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8U3C2pipfC3
Name (+/-)-3-(trans-4'-hydroxy-4'-methyl-rel-1'-cyclohexyl)butanal
Alternate Name(s) (S)-3-((1r,4S)-4-hydroxy-4-methylcyclohexyl)butanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-9(5-8-12)10-3-6-11(2,13)7-4-10/h8-10,13H,3-7H2,1-2H3/t9?,10-,11-
InChIKey JBFNGHDRDZVHBO-JQTAXMAWSA-N
Literature Reference DOI 10.1002/hlca.19800630109
Molecular Weight 184.279 g/mol
SMILES O[C@]1(CC[C@@](CC1)(C(C)CC=O)[H])C
SPLASH splash10-00di-9000000000-454f8762576aa83b2b3e
Source of Spectrum H-63-91-28
Wiley ID 1797426