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3-Hexen-2-one, 3-(methylphenylamino)-1-phenyl-

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

3-Hexen-2-one, 3-(methylphenylamino)-1-phenyl-
SpectraBase Compound ID HfTMJB1O918
InChI InChI=1S/C19H21NO/c1-3-10-18(20(2)17-13-8-5-9-14-17)19(21)15-16-11-6-4-7-12-16/h4-14H,3,15H2,1-2H3/b18-10+
InChIKey QDSRZUNLFMUKSF-VCHYOVAHSA-N
Mol Weight 279.38 g/mol
Molecular Formula C19H21NO
Exact Mass 279.162314 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2Rwb86181A7
Name 3-Hexen-2-one, 3-(methylphenylamino)-1-phenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.162314299 u
Formula C19H21NO
InChI InChI=1S/C19H21NO/c1-3-10-18(20(2)17-13-8-5-9-14-17)19(21)15-16-11-6-4-7-12-16/h4-14H,3,15H2,1-2H3/b18-10+
InChIKey QDSRZUNLFMUKSF-VCHYOVAHSA-N
SMILES C1(N(\C(C(CC2=CC=CC=C2)=O)=C/CC)C)=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.873374