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trans-3-Hexyl-2-phenylcyclohexan-1-one
SpectraBase Compound ID 6pYujhVCR4v
InChI InChI=1S/C18H26O/c1-2-3-4-6-10-16-13-9-14-17(19)18(16)15-11-7-5-8-12-15/h5,7-8,11-12,16,18H,2-4,6,9-10,13-14H2,1H3/t16-,18+/m1/s1
InChIKey JROLXIVNSISMRU-AEFFLSMTSA-N
Mol Weight 258.4 g/mol
Molecular Formula C18H26O
Exact Mass 258.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhYb5RRYw9Q
Name trans-3-Hexyl-2-phenylcyclohexan-1-one
Alternate Name(s) (2R,3R)-3-hexyl-2-phenylcyclohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O
InChI InChI=1S/C18H26O/c1-2-3-4-6-10-16-13-9-14-17(19)18(16)15-11-7-5-8-12-15/h5,7-8,11-12,16,18H,2-4,6,9-10,13-14H2,1H3/t16-,18+/m1/s1
InChIKey JROLXIVNSISMRU-AEFFLSMTSA-N
Literature Reference DOI 10.1039/C5CC09837H
Molecular Weight 258.405 g/mol
SMILES C1([C@]([C@@](CCC1)(CCCCCC)[H])(c1ccccc1)[H])=O
SPLASH splash10-05ox-6910000000-545fcd0ad2c17a8d2890
Source of Spectrum KD-52-2382/SM20-3y
Wiley ID 1803737