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2-[(4-Methylphenyl)methylidene]-1H-indol-3-one

View entire compound with spectra: 1 NMR, and 1 FTIR

2-[(4-Methylphenyl)methylidene]-1H-indol-3-one
SpectraBase Compound ID 7rHeJwWaFL0
InChI InChI=1S/C16H13NO/c1-11-6-8-12(9-7-11)10-15-16(18)13-4-2-3-5-14(13)17-15/h2-10,17H,1H3/b15-10+
InChIKey LSSJMZKOASZVNW-XNTDXEJSSA-N
Mol Weight 235.29 g/mol
Molecular Formula C16H13NO
Exact Mass 235.099714 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID VWVonlbnxV
Name 2-[(4-Methylphenyl)methylidene]-1H-indol-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.099714042 u
Formula C16H13NO
InChI InChI=1S/C16H13NO/c1-11-6-8-12(9-7-11)10-15-16(18)13-4-2-3-5-14(13)17-15/h2-10,17H,1H3/b15-10+
InChIKey LSSJMZKOASZVNW-XNTDXEJSSA-N
Molecular Weight 235.286 g/mol
SMILES CC1=CC=C(\C=C/2NC3=CC=CC=C3C2=O)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906164