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(5S)-5-isopropenyl-2,4,4-trimethyl-3-phenethyl-cyclohex-2-en-1-one
SpectraBase Compound ID 9QZm64PwzZq
InChI InChI=1S/C20H26O/c1-14(2)18-13-19(21)15(3)17(20(18,4)5)12-11-16-9-7-6-8-10-16/h6-10,18H,1,11-13H2,2-5H3/t18-/m0/s1
InChIKey XYCJKXAJOVNSNB-SFHVURJKSA-N
Mol Weight 282.43 g/mol
Molecular Formula C20H26O
Exact Mass 282.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXBioCF922a
Name (5S)-5-isopropenyl-2,4,4-trimethyl-3-phenethyl-cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O
InChI InChI=1S/C20H26O/c1-14(2)18-13-19(21)15(3)17(20(18,4)5)12-11-16-9-7-6-8-10-16/h6-10,18H,1,11-13H2,2-5H3/t18-/m0/s1
InChIKey XYCJKXAJOVNSNB-SFHVURJKSA-N
Molecular Weight 282.427 g/mol
SMILES C=1(C([C@@](C(=C)C)([H])CC(C1C)=O)(C)C)CCc1ccccc1
SPLASH splash10-0006-9750000000-4c78966aea04232159d5
Source of Spectrum KC-0-3144-6
Synonyms (5S)-2,4,4-trimethyl-5-(1-methylethenyl)-3-(2-phenylethyl)-1-cyclohex-2-enone (5S)-2,4,4-trimethyl-3-(2-phenylethyl)-5-prop-1-en-2-ylcyclohex-2-en-1-one (5S)-5-isopropenyl-2,4,4-trimethyl-3-(2-phenylethyl)cyclohex-2-en-1-one
Wiley ID 826662