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3,6-Dimethoxy-9,10-diphenylphenanthrene

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

3,6-Dimethoxy-9,10-diphenylphenanthrene
SpectraBase Compound ID 3xBLsBpvtVc
InChI InChI=1S/C28H22O2/c1-29-21-13-15-23-25(17-21)26-18-22(30-2)14-16-24(26)28(20-11-7-4-8-12-20)27(23)19-9-5-3-6-10-19/h3-18H,1-2H3
InChIKey WAOHBABEMWEUQQ-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 3t4nPAF2os7
Name 3,6-Dimethoxy-9,10-diphenylphenanthrene
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/c1-29-21-13-15-23-25(17-21)26-18-22(30-2)14-16-24(26)28(20-11-7-4-8-12-20)27(23)19-9-5-3-6-10-19/h3-18H,1-2H3
InChIKey WAOHBABEMWEUQQ-UHFFFAOYSA-N
Molecular Weight 390.482 g/mol
SMILES C1(=C(C2=CC=C(C=C2C=2C1=CC=C(OC)C2)OC)C1=CC=CC=C1)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.86244