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3-(3-(3-p-Tolylacryloyl)-2H-chromen-2-one

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

3-(3-(3-p-Tolylacryloyl)-2H-chromen-2-one
SpectraBase Compound ID 8JvTxGaWw7M
InChI InChI=1S/C19H14O3/c1-13-6-8-14(9-7-13)10-11-17(20)16-12-15-4-2-3-5-18(15)22-19(16)21/h2-12H,1H3/b11-10+
InChIKey AATSBMDVPMQDEG-ZHACJKMWSA-N
Mol Weight 290.32 g/mol
Molecular Formula C19H14O3
Exact Mass 290.094294 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JDCm11s2wuC
Name 3-(3-(3-p-Tolylacryloyl)-2H-chromen-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.094294308 u
Formula C19H14O3
InChI InChI=1S/C19H14O3/c1-13-6-8-14(9-7-13)10-11-17(20)16-12-15-4-2-3-5-18(15)22-19(16)21/h2-12H,1H3/b11-10+
InChIKey AATSBMDVPMQDEG-ZHACJKMWSA-N
SMILES C=1(C(OC=2C(C1)=CC=CC2)=O)C(\C=C\C1=CC=C(C=C1)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.948439