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1-(2-Hydroxy-4-methoxyphenyl)-3-phenyl-1-propanone, o-acetyl

View entire compound with spectra: 1 NMR, and 1 FTIR

1-(2-Hydroxy-4-methoxyphenyl)-3-phenyl-1-propanone, o-acetyl
SpectraBase Compound ID JSbutHpgpYc
InChI InChI=1S/C18H18O4/c1-13(19)22-18-12-15(21-2)9-10-16(18)17(20)11-8-14-6-4-3-5-7-14/h3-7,9-10,12H,8,11H2,1-2H3
InChIKey ZZOBJEOFSXHRHS-UHFFFAOYSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 34lSqYtoc7X
Name 1-(2-Hydroxy-4-methoxyphenyl)-3-phenyl-1-propanone, o-acetyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 298.120509056 u
Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-13(19)22-18-12-15(21-2)9-10-16(18)17(20)11-8-14-6-4-3-5-7-14/h3-7,9-10,12H,8,11H2,1-2H3
InChIKey ZZOBJEOFSXHRHS-UHFFFAOYSA-N
SMILES C(CCC1=CC=CC=C1)(=O)C1=CC=C(OC)C=C1OC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.800268