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Bicyclo[3.1.0]hexan-2-one, 6,6-diphenyl-

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

Bicyclo[3.1.0]hexan-2-one, 6,6-diphenyl-
SpectraBase Compound ID CNDJSl1cwmE
InChI InChI=1S/C18H16O/c19-16-12-11-15-17(16)18(15,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,17H,11-12H2
InChIKey VTSHOBCICLBCCZ-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C18H16O
Exact Mass 248.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 98l8HyH5Gw5
Name Bicyclo[3.1.0]hexan-2-one, 6,6-diphenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.120115134 u
Formula C18H16O
InChI InChI=1S/C18H16O/c19-16-12-11-15-17(16)18(15,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,17H,11-12H2
InChIKey VTSHOBCICLBCCZ-UHFFFAOYSA-N
Molecular Weight 248.325 g/mol
SMILES C1(=O)C2C(C3=CC=CC=C3)(C3=CC=CC=C3)C2CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.911546