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5-Methylene-1,2,3,4-tetraphenylcyclopentadiene

View entire compound with spectra: 6 NMR, 1 FTIR, 1 Raman, and 2 MS (GC)

5-Methylene-1,2,3,4-tetraphenylcyclopentadiene
SpectraBase Compound ID 1k2S12kADdU
InChI InChI=1S/C30H22/c1-22-27(23-14-6-2-7-15-23)29(25-18-10-4-11-19-25)30(26-20-12-5-13-21-26)28(22)24-16-8-3-9-17-24/h2-21H,1H2
InChIKey JWCQJEMOTHGHHH-UHFFFAOYSA-N
Mol Weight 382.51 g/mol
Molecular Formula C30H22
Exact Mass 382.172151 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 3RdmeFN1dJ2
Name 5-Methylene-1,2,3,4-tetraphenylcyclopentadiene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.172150708 u
Formula C30H22
InChI InChI=1S/C30H22/c1-22-27(23-14-6-2-7-15-23)29(25-18-10-4-11-19-25)30(26-20-12-5-13-21-26)28(22)24-16-8-3-9-17-24/h2-21H,1H2
InChIKey JWCQJEMOTHGHHH-UHFFFAOYSA-N
Molecular Weight 382.506 g/mol
SMILES C=1C(=CC=CC1)C=1C(=C(C(C1C=1C=CC=CC1)=C)C=1C=CC=CC1)C=1C=CC=CC1
Spectrum/Structure Validation Score (Raman) 0.989386