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2-(1-Hydroxy-1-phenylethyl)-1-methyl-4-quinolone
SpectraBase Compound ID 1fM8sZMFJaE
InChI InChI=1S/C18H17NO2/c1-18(21,13-8-4-3-5-9-13)17-12-16(20)14-10-6-7-11-15(14)19(17)2/h3-12,21H,1-2H3
InChIKey GVSGSKINYIAOPW-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C18H17NO2
Exact Mass 279.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AXoTiZxfWTX
Name 2-(1-Hydroxy-1-phenylethyl)-1-methyl-4-quinolone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.125928789 u
Formula C18H17NO2
InChI InChI=1S/C18H17NO2/c1-18(21,13-8-4-3-5-9-13)17-12-16(20)14-10-6-7-11-15(14)19(17)2/h3-12,21H,1-2H3
InChIKey GVSGSKINYIAOPW-UHFFFAOYSA-N
Molecular Weight 279.339 g/mol
SMILES C=1(N(C=2C=CC=CC2C(C1)=O)C)C(C1=CC=CC=C1)(O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.840548