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Trans-6-carboxy-2-styrylchromone

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Trans-6-carboxy-2-styrylchromone
SpectraBase Compound ID 23iwR6TmaQh
InChI InChI=1S/C18H12O4/c19-16-11-14(8-6-12-4-2-1-3-5-12)22-17-9-7-13(18(20)21)10-15(16)17/h1-11H,(H,20,21)/b8-6+
InChIKey XKLXSYLOEQJQLH-SOFGYWHQSA-N
Mol Weight 292.29 g/mol
Molecular Formula C18H12O4
Exact Mass 292.073559 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7sAfKclMQof
Name Trans-6-carboxy-2-styrylchromone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 292.073558862 u
Formula C18H12O4
InChI InChI=1S/C18H12O4/c19-16-11-14(8-6-12-4-2-1-3-5-12)22-17-9-7-13(18(20)21)10-15(16)17/h1-11H,(H,20,21)/b8-6+
InChIKey XKLXSYLOEQJQLH-SOFGYWHQSA-N
SMILES C1=C(C=C2C(=C1)OC(=CC2=O)\C=C\C1=CC=CC=C1)C(=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.822227