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6-Triphenylmethyl-1,2-naphthoquinone

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

6-Triphenylmethyl-1,2-naphthoquinone
SpectraBase Compound ID KWXwdzhC7lT
InChI InChI=1S/C29H20O2/c30-27-19-16-21-20-25(17-18-26(21)28(27)31)29(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-20H
InChIKey OFKXXSAWDCMHCE-UHFFFAOYSA-N
Mol Weight 400.48 g/mol
Molecular Formula C29H20O2
Exact Mass 400.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GEjQYNrid7Y
Name 6-Triphenylmethyl-1,2-naphthoquinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.146329882 u
Formula C29H20O2
InChI InChI=1S/C29H20O2/c30-27-19-16-21-20-25(17-18-26(21)28(27)31)29(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-20H
InChIKey OFKXXSAWDCMHCE-UHFFFAOYSA-N
Molecular Weight 400.477 g/mol
SMILES C1(C(C=CC=2C=C(C=CC12)C(C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955428