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(2E,5E)-2,5-bis(4-methylbenzylidene)cyclopentanone
SpectraBase Compound ID BP5icpU0OGP
InChI InChI=1S/C21H20O/c1-15-3-7-17(8-4-15)13-19-11-12-20(21(19)22)14-18-9-5-16(2)6-10-18/h3-10,13-14H,11-12H2,1-2H3/b19-13+,20-14+
InChIKey IXIITVGWLWCRQL-IWGRKNQJSA-N
Mol Weight 288.39 g/mol
Molecular Formula C21H20O
Exact Mass 288.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67l1bBjLX0V
Name (2E,5E)-2,5-bis(4-methylbenzylidene)cyclopentanone
Alternate Name(s) (2E,5E)-2,5-bis(p-tolylmethylene)cyclopentanone (2E,5E)-2,5-bis[(4-methylphenyl)methylidene]-1-cyclopentanone (2E,5E)-2,5-bis[(4-methylphenyl)methylidene]cyclopentan-1-one
CAS Registry Number 106115-47-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O
InChI InChI=1S/C21H20O/c1-15-3-7-17(8-4-15)13-19-11-12-20(21(19)22)14-18-9-5-16(2)6-10-18/h3-10,13-14H,11-12H2,1-2H3/b19-13+,20-14+
InChIKey IXIITVGWLWCRQL-IWGRKNQJSA-N
Molecular Weight 288.390 g/mol
SMILES C1(\C(CC\C1=C\c1ccc(cc1)C)=C\c1ccc(cc1)C)=O
SPLASH splash10-0079-0190000000-e61c2e233f244d29e293
Source of Spectrum K-120-389-1
Wiley ID 1292323