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2,2-Dimethyl-3,5-diphenyl-2H-pyrrole

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

2,2-Dimethyl-3,5-diphenyl-2H-pyrrole
SpectraBase Compound ID CSHFuX6lNsT
InChI InChI=1S/C18H17N/c1-18(2)16(14-9-5-3-6-10-14)13-17(19-18)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKey JZMJAOPPDSXWSA-UHFFFAOYSA-N
Mol Weight 247.34 g/mol
Molecular Formula C18H17N
Exact Mass 247.1361 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JmAHDgLzC3q
Name 2,2-Dimethyl-3,5-diphenyl-2H-pyrrole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 247.136099551 u
Formula C18H17N
InChI InChI=1S/C18H17N/c1-18(2)16(14-9-5-3-6-10-14)13-17(19-18)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKey JZMJAOPPDSXWSA-UHFFFAOYSA-N
Molecular Weight 247.341 g/mol
SMILES C1(N=C(C=C1C=1C=CC=CC1)C1=CC=CC=C1)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.932622