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6-Hydroxy-3-(1-hydroxy-2-naphthoyl)-2-methyl-benzoic acid methyl ester
SpectraBase Compound ID KOTINNLKhKV
InChI InChI=1S/C20H16O5/c1-11-13(9-10-16(21)17(11)20(24)25-2)18(22)15-8-7-12-5-3-4-6-14(12)19(15)23/h3-10,21,23H,1-2H3
InChIKey JXMPZZHWNUEOSP-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C20H16O5
Exact Mass 336.099774 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1AmiDmr1hfG
Name 6-Hydroxy-3-(1-hydroxy-2-naphthoyl)-2-methyl-benzoic acid methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.099773610 u
Formula C20H16O5
InChI InChI=1S/C20H16O5/c1-11-13(9-10-16(21)17(11)20(24)25-2)18(22)15-8-7-12-5-3-4-6-14(12)19(15)23/h3-10,21,23H,1-2H3
InChIKey JXMPZZHWNUEOSP-UHFFFAOYSA-N
Molecular Weight 336.343 g/mol
SMILES C=1(C(C=2C(=C(C(=O)OC)C(=CC2)O)C)=O)C(=C2C=CC=CC2=CC1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.908132