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Cyclohexanone, 4-(1,1-dimethylethyl)-2-(4-methylphenyl)-
SpectraBase Compound ID I9KD7IKWBnR
InChI InChI=1S/C17H24O/c1-12-5-7-13(8-6-12)15-11-14(17(2,3)4)9-10-16(15)18/h5-8,14-15H,9-11H2,1-4H3/t14-,15+/m1/s1
InChIKey QPPCRASXBDXJON-CABCVRRESA-N
Mol Weight 244.38 g/mol
Molecular Formula C17H24O
Exact Mass 244.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1xKAi8Tmgh
Name Cyclohexanone, 4-(1,1-dimethylethyl)-2-(4-methylphenyl)-
Alternate Name(s) (2S,4R)-4-tert-butyl-2-(4-methylphenyl)cyclohexanone cis-4-t-butyl-2-(p-tolyl)cyclohexanone
CAS Registry Number 87240-65-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O
InChI InChI=1S/C17H24O/c1-12-5-7-13(8-6-12)15-11-14(17(2,3)4)9-10-16(15)18/h5-8,14-15H,9-11H2,1-4H3/t14-,15+/m1/s1
InChIKey QPPCRASXBDXJON-CABCVRRESA-N
Molecular Weight 244.378 g/mol
SMILES [C@@]1(C[C@](C(C)(C)C)(CCC1=O)[H])(c1ccc(cc1)C)[H]
SPLASH splash10-0a4u-2910000000-a785d93d29cca5730dd1
Source of Spectrum B-36-793-0
Wiley ID 1247568