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2-Cyclohexen-1-one, 6-(acetyloxy)-5,5-dimethyl-3-phenyl-
SpectraBase Compound ID IvKHB5a2Aqz
InChI InChI=1S/C16H18O3/c1-11(17)19-15-14(18)9-13(10-16(15,2)3)12-7-5-4-6-8-12/h4-9,15H,10H2,1-3H3
InChIKey PSHWJEMLAYKAEM-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uCmVfXbhK8
Name 2-Cyclohexen-1-one, 6-(acetyloxy)-5,5-dimethyl-3-phenyl-
Alternate Name(s) 6,6-Dimethyl-2-oxo-4-phenyl-3-cyclohexen-1-yl acetate 6-Acetoxy-5,5-dimethyl-3-phenyl-2-cyclohexene-1-one
CAS Registry Number 108946-85-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-11(17)19-15-14(18)9-13(10-16(15,2)3)12-7-5-4-6-8-12/h4-9,15H,10H2,1-3H3
InChIKey PSHWJEMLAYKAEM-UHFFFAOYSA-N
Molecular Weight 258.317 g/mol
SMILES C1(=CC(=O)C(C(C1)(C)C)OC(=O)C)c1ccccc1
SPLASH splash10-0006-0910000000-ba0aa74a94bbc4448631
Source of Spectrum K-120-1148-23
Wiley ID 1262050