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(4RS,5SR)-2,4-Dimethyl-5-phenylnonan-3-one
SpectraBase Compound ID 8Z6Waf646Wq
InChI InChI=1S/C17H26O/c1-5-6-12-16(14(4)17(18)13(2)3)15-10-8-7-9-11-15/h7-11,13-14,16H,5-6,12H2,1-4H3
InChIKey GQVOPWAPKTYGIA-UHFFFAOYSA-N
Mol Weight 246.39 g/mol
Molecular Formula C17H26O
Exact Mass 246.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WU2tzBIdKj
Name (4RS,5SR)-2,4-Dimethyl-5-phenylnonan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O
InChI InChI=1S/C17H26O/c1-5-6-12-16(14(4)17(18)13(2)3)15-10-8-7-9-11-15/h7-11,13-14,16H,5-6,12H2,1-4H3
InChIKey GQVOPWAPKTYGIA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000412
Molecular Weight 246.394 g/mol
SMILES CC(C(C(C(CCCC)c1ccccc1)C)=O)C
SPLASH splash10-0007-9820000000-e6033be78ebf45f094c1
Source of Spectrum ASC-352-2281/SM17-rac_13
Synonyms 2,4-Dimethyl-5-phenylnonan-3-one
Wiley ID 1763985