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(Z)-2-Butyl-3-chloro-1-phenylhept-2-en-1-one

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

(Z)-2-Butyl-3-chloro-1-phenylhept-2-en-1-one
SpectraBase Compound ID 4ZQFcZspL1C
InChI InChI=1S/C17H23ClO/c1-3-5-12-15(16(18)13-6-4-2)17(19)14-10-8-7-9-11-14/h7-11H,3-6,12-13H2,1-2H3/b16-15-
InChIKey ZCEFBGTXXMEXFB-NXVVXOECSA-N
Mol Weight 278.82 g/mol
Molecular Formula C17H23ClO
Exact Mass 278.143743 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID L96JLAaDJNu
Name (Z)-2-Butyl-3-chloro-1-phenylhept-2-en-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.143743060 u
Formula C17H23ClO
InChI InChI=1S/C17H23ClO/c1-3-5-12-15(16(18)13-6-4-2)17(19)14-10-8-7-9-11-14/h7-11H,3-6,12-13H2,1-2H3/b16-15-
InChIKey ZCEFBGTXXMEXFB-NXVVXOECSA-N
SMILES C(\C(=C\(Cl)CCCC)CCCC)(=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.886382