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Sinensol H

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

Sinensol H
SpectraBase Compound ID FbUz6oOck29
InChI InChI=1S/C35H30O6/c1-41-30-19-29(38)32-25(27(30)17-20-7-11-23(36)12-8-20)15-16-26-28(18-21-9-13-24(37)14-10-21)34(39)31(35(40)33(26)32)22-5-3-2-4-6-22/h2-14,19,36-40H,15-18H2,1H3
InChIKey AYCMOFRTAVBQIM-UHFFFAOYSA-N
Mol Weight 546.6 g/mol
Molecular Formula C35H30O6
Exact Mass 546.204239 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HdTz2uZcvOf
Name Sinensol H
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 546.204238680 u
Formula C35H30O6
InChI InChI=1S/C35H30O6/c1-41-30-19-29(38)32-25(27(30)17-20-7-11-23(36)12-8-20)15-16-26-28(18-21-9-13-24(37)14-10-21)34(39)31(35(40)33(26)32)22-5-3-2-4-6-22/h2-14,19,36-40H,15-18H2,1H3
InChIKey AYCMOFRTAVBQIM-UHFFFAOYSA-N
Molecular Weight 546.619 g/mol
SMILES C1=2C3=C(C(CC4=CC=C(C=C4)O)=C(C=C3O)OC)CCC1=C(CC=1C=CC(=CC1)O)C(=C(C2O)C1=CC=CC=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.881692