4,6,8-Triphenylbicyclo[3.3.1]non-6-en-2-one

SpectraBase Compound ID	InGU2sc1oy2
InChI	InChI=1S/C27H24O/c28-27-18-24(21-14-8-3-9-15-21)25-17-26(27)23(20-12-6-2-7-13-20)16-22(25)19-10-4-1-5-11-19/h1-16,23-26H,17-18H2
InChIKey	HTCJYPYKQMPNMD-UHFFFAOYSA-N Google Search
Mol Weight	364.49 g/mol
Molecular Formula	C27H24O
Exact Mass	364.182715 g/mol

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SpectraBase Spectrum ID	IO3MWwRr7zT
Name	4,6,8-Triphenylbicyclo[3.3.1]non-6-en-2-one
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	364.182715392 u
Formula	C27H24O
InChI	InChI=1S/C27H24O/c28-27-18-24(21-14-8-3-9-15-21)25-17-26(27)23(20-12-6-2-7-13-20)16-22(25)19-10-4-1-5-11-19/h1-16,23-26H,17-18H2
InChIKey	HTCJYPYKQMPNMD-UHFFFAOYSA-N
Molecular Weight	364.488 g/mol
SMILES	C=1(C2C(CC(C(C(C1)C=1C=CC=CC1)C2)=O)C=1C=CC=CC1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR)	0.949111