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2H-1-Benzopyran-2-one, 4-[2-(2-hydroxyphenyl)-1-methyl-2-oxoethoxy]-3-methyl-
SpectraBase Compound ID Bw1xy9mlBZJ
InChI InChI=1S/C19H16O5/c1-11-18(14-8-4-6-10-16(14)24-19(11)22)23-12(2)17(21)13-7-3-5-9-15(13)20/h3-10,12,20H,1-2H3
InChIKey WXOGVNUGHOGBAR-UHFFFAOYSA-N
Mol Weight 324.33 g/mol
Molecular Formula C19H16O5
Exact Mass 324.099774 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID I1cHHw0CJFc
Name 2H-1-Benzopyran-2-one, 4-[2-(2-hydroxyphenyl)-1-methyl-2-oxoethoxy]-3-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.099773610 u
Formula C19H16O5
InChI InChI=1S/C19H16O5/c1-11-18(14-8-4-6-10-16(14)24-19(11)22)23-12(2)17(21)13-7-3-5-9-15(13)20/h3-10,12,20H,1-2H3
InChIKey WXOGVNUGHOGBAR-UHFFFAOYSA-N
Molecular Weight 324.332 g/mol
SMILES C1(=C(C(=O)OC=2C1=CC=CC2)C)OC(C(C=1C(O)=CC=CC1)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.80486