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(Z)-2-methyl-3-phenyl-4-(1-phenylbutylidene)cyclopent-2-enone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(Z)-2-methyl-3-phenyl-4-(1-phenylbutylidene)cyclopent-2-enone
SpectraBase Compound ID L88lb5Vme0N
InChI InChI=1S/C22H22O/c1-3-10-19(17-11-6-4-7-12-17)20-15-21(23)16(2)22(20)18-13-8-5-9-14-18/h4-9,11-14H,3,10,15H2,1-2H3/b20-19-
InChIKey JYEKPJYEOUJVFC-VXPUYCOJSA-N
Mol Weight 302.42 g/mol
Molecular Formula C22H22O
Exact Mass 302.167065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9eL6aRVwXIK
Name (Z)-2-Methyl-3-phenyl-4-(1-phenylbutylidene)cyclopent-2-enone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.167065327 u
Formula C22H22O
InChI InChI=1S/C22H22O/c1-3-10-19(17-11-6-4-7-12-17)20-15-21(23)16(2)22(20)18-13-8-5-9-14-18/h4-9,11-14H,3,10,15H2,1-2H3/b20-19-
InChIKey JYEKPJYEOUJVFC-VXPUYCOJSA-N
Molecular Weight 302.417 g/mol
SMILES C=1(C2=CC=CC=C2)\C(=C/(C2=CC=CC=C2)CCC)CC(C1C)=O