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(R)-1-(3,5-Dimethoxyphenyl)-1-hydroxy-4-phenylbut-3-en-2-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(R)-1-(3,5-Dimethoxyphenyl)-1-hydroxy-4-phenylbut-3-en-2-one
SpectraBase Compound ID CA21o1L2TRr
InChI InChI=1S/C18H18O4/c1-21-15-10-14(11-16(12-15)22-2)18(20)17(19)9-8-13-6-4-3-5-7-13/h3-12,18,20H,1-2H3/b9-8-/t18-/m1/s1
InChIKey SLOCBMKWTSLHSL-CNZFZVQHSA-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 1LNON9iX8Zw
Name (R)-1-(3,5-Dimethoxyphenyl)-1-hydroxy-4-phenylbut-3-en-2-one
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/c1-21-15-10-14(11-16(12-15)22-2)18(20)17(19)9-8-13-6-4-3-5-7-13/h3-12,18,20H,1-2H3/b9-8-/t18-/m1/s1
InChIKey SLOCBMKWTSLHSL-CNZFZVQHSA-N
SMILES [C@](C(\C=C/C=1C=CC=CC1)=O)(O)(C=1C=C(C=C(C1)OC)OC)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962712