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1,7-Diphenylhept-2-en-1-one

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

1,7-Diphenylhept-2-en-1-one
SpectraBase Compound ID E4J5MiaoQht
InChI InChI=1S/C19H20O/c20-19(18-14-8-4-9-15-18)16-10-2-1-5-11-17-12-6-3-7-13-17/h3-4,6-10,12-16H,1-2,5,11H2/b16-10+
InChIKey XZTBDENIZQDQKV-MHWRWJLKSA-N
Mol Weight 264.37 g/mol
Molecular Formula C19H20O
Exact Mass 264.151415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID G25V6pRmjC6
Name 1,7-Diphenylhept-2-en-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.151415263 u
Formula C19H20O
InChI InChI=1S/C19H20O/c20-19(18-14-8-4-9-15-18)16-10-2-1-5-11-17-12-6-3-7-13-17/h3-4,6-10,12-16H,1-2,5,11H2/b16-10+
InChIKey XZTBDENIZQDQKV-MHWRWJLKSA-N
Molecular Weight 264.368 g/mol
SMILES C(\C=C\CCCCC=1C=CC=CC1)(=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961652