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5-Methoxy-4-(3-methoxyphenyl)-2H-1-benzopyran-2-one
SpectraBase Compound ID 8QyIV7ndJhu
InChI InChI=1S/C17H14O4/c1-19-12-6-3-5-11(9-12)13-10-16(18)21-15-8-4-7-14(20-2)17(13)15/h3-10H,1-2H3
InChIKey PFMJNNYZKWAPDZ-UHFFFAOYSA-N
Mol Weight 282.3 g/mol
Molecular Formula C17H14O4
Exact Mass 282.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9zXOrrLiMex
Name 5-Methoxy-4-(3-methoxyphenyl)-2H-1-benzopyran-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.089208927 u
Formula C17H14O4
InChI InChI=1S/C17H14O4/c1-19-12-6-3-5-11(9-12)13-10-16(18)21-15-8-4-7-14(20-2)17(13)15/h3-10H,1-2H3
InChIKey PFMJNNYZKWAPDZ-UHFFFAOYSA-N
SMILES C1(OC2=CC=CC(=C2C(=C1)C1=CC(OC)=CC=C1)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.911534