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3-Methoxy-4,5-diphenyltricyclo[8.4.1.0(2,7)]pentadeca-1(14),2(7),3,5,8,10,12-heptaen-6-ol
SpectraBase Compound ID GrqfYPN0CXg
InChI InChI=1S/C28H22O2/c1-30-28-24-22-15-9-8-10-19(18-22)16-17-23(24)27(29)25(20-11-4-2-5-12-20)26(28)21-13-6-3-7-14-21/h2-17,29H,18H2,1H3
InChIKey WKHXKJHDZGIGKX-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C28H22O2
Exact Mass 390.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BCOZ6ubdEbB
Name 3-Methoxy-4,5-diphenyltricyclo[8.4.1.0(2,7)]pentadeca-1(14),2(7),3,5,8,10,12-heptaen-6-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.161979946 u
Formula C28H22O2
InChI InChI=1S/C28H22O2/c1-30-28-24-22-15-9-8-10-19(18-22)16-17-23(24)27(29)25(20-11-4-2-5-12-20)26(28)21-13-6-3-7-14-21/h2-17,29H,18H2,1H3
InChIKey WKHXKJHDZGIGKX-UHFFFAOYSA-N
Molecular Weight 390.482 g/mol
SMILES C12=C(C(OC)=C(C(=C2O)C=2C=CC=CC2)C=2C=CC=CC2)C=2CC(C=C1)=CC=CC2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915201