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1-(4-Hydroxy-3-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)-ethane

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

1-(4-Hydroxy-3-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)-ethane
SpectraBase Compound ID DjY1WplAPhI
InChI InChI=1S/C18H22O5/c1-20-15-9-12(7-8-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h7-11,19H,5-6H2,1-4H3
InChIKey NRAJPMHEOBLUQC-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C18H22O5
Exact Mass 318.146724 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KhQxEXpvt5a
Name 1-(4-Hydroxy-3-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)-ethane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.146723803 u
Formula C18H22O5
InChI InChI=1S/C18H22O5/c1-20-15-9-12(7-8-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h7-11,19H,5-6H2,1-4H3
InChIKey NRAJPMHEOBLUQC-UHFFFAOYSA-N
Molecular Weight 318.369 g/mol
SMILES C=1(O)C=CC(=CC1OC)CCC1=CC(OC)=C(OC)C(OC)=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91924