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2'-(Acetyl)oxy-4-methoxy-5'-methylchalcone

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

2'-(Acetyl)oxy-4-methoxy-5'-methylchalcone
SpectraBase Compound ID JpnuPsGx3al
InChI InChI=1S/C19H18O4/c1-13-4-11-19(23-14(2)20)17(12-13)18(21)10-7-15-5-8-16(22-3)9-6-15/h4-12H,1-3H3/b10-7+
InChIKey GPITWTOPXQICKT-JXMROGBWSA-N
Mol Weight 310.35 g/mol
Molecular Formula C19H18O4
Exact Mass 310.120509 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FIdp2NrfwtD
Name 2'-(Acetyl)oxy-4-methoxy-5'-methylchalcone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.120509056 u
Formula C19H18O4
InChI InChI=1S/C19H18O4/c1-13-4-11-19(23-14(2)20)17(12-13)18(21)10-7-15-5-8-16(22-3)9-6-15/h4-12H,1-3H3/b10-7+
InChIKey GPITWTOPXQICKT-JXMROGBWSA-N
Molecular Weight 310.349 g/mol
SMILES C1(=C(C=CC(=C1)C)OC(C)=O)C(\C=C\C=1C=CC(=CC1)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.842511