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3-Benzoyl-2,3,5,5-tetramethyl-1-heptene
SpectraBase Compound ID 9O6HIUh5bri
InChI InChI=1S/C18H26O/c1-7-17(4,5)13-18(6,14(2)3)16(19)15-11-9-8-10-12-15/h8-12H,2,7,13H2,1,3-6H3
InChIKey VGMLFMXYEXOPFU-UHFFFAOYSA-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 4XGe98k1mUM
Name 3-Benzoyl-2,3,5,5-tetramethyl-1-heptene
Alternate Name(s) 2-(2,2-dimethylbutyl)-2,3-dimethyl-1-phenyl-3-buten-1-one 2,4,4-trimethyl-2-(1-methylethenyl)-1-phenyl-1-hexanone 2,4,4-trimethyl-1-phenyl-2-prop-1-en-2-ylhexan-1-one 2-isopropenyl-2,4,4-trimethyl-1-phenyl-hexan-1-one 2,4,4-trimethyl-1-phenyl-2-prop-1-en-2-yl-hexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O
InChI InChI=1S/C18H26O/c1-7-17(4,5)13-18(6,14(2)3)16(19)15-11-9-8-10-12-15/h8-12H,2,7,13H2,1,3-6H3
InChIKey VGMLFMXYEXOPFU-UHFFFAOYSA-N
Molecular Weight 258.405 g/mol
SMILES C=C(C(CC(CC)(C)C)(C)C(c1ccccc1)=O)C
SPLASH splash10-0a4i-3900000000-922087b27ad653e0e9a0
Source of Spectrum F-69-576-9
Wiley ID 1594617