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1,4-Ethenoisoquinolin-3(2H)-one, 1,4-dihydro-2-(2-phenylethenyl)-, (E)-

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

1,4-Ethenoisoquinolin-3(2H)-one, 1,4-dihydro-2-(2-phenylethenyl)-, (E)-
SpectraBase Compound ID InhyeHS5vgK
InChI InChI=1S/C19H15NO/c21-19-17-10-11-18(16-9-5-4-8-15(16)17)20(19)13-12-14-6-2-1-3-7-14/h1-13,17-18H/b13-12+
InChIKey BDMDDDBLSDQOHG-OUKQBFOZSA-N
Mol Weight 273.33 g/mol
Molecular Formula C19H15NO
Exact Mass 273.115364 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 49uAd0QJ38N
Name 1,4-Ethenoisoquinolin-3(2H)-one, 1,4-dihydro-2-(2-phenylethenyl)-, (E)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.115364106 u
Formula C19H15NO
InChI InChI=1S/C19H15NO/c21-19-17-10-11-18(16-9-5-4-8-15(16)17)20(19)13-12-14-6-2-1-3-7-14/h1-13,17-18H/b13-12+
InChIKey BDMDDDBLSDQOHG-OUKQBFOZSA-N
SMILES C1(N(C2C=CC1C1=C2C=CC=C1)\C=C\C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906257