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Benzo[ghi]perylene

View entire compound with spectra: 3 NMR, 3 FTIR, 1 Raman, and 17 MS (GC)

Benzo[ghi]perylene
SpectraBase Compound ID 1NE8YKRuEIV
InChI InChI=1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H
InChIKey GYFAGKUZYNFMBN-UHFFFAOYSA-N
Mol Weight 276.34 g/mol
Molecular Formula C22H12
Exact Mass 276.0939 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID IIKMvYCP8FE
Name Benzo[ghi]perylene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 276.093900386 u
Formula C22H12
InChI InChI=1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H
InChIKey GYFAGKUZYNFMBN-UHFFFAOYSA-N
Molecular Weight 276.338 g/mol
SMILES C1=CC=C2C3=C4C(=CC=C3)C=CC3=C4C=4C2=C1C=CC4C=C3
Spectrum/Structure Validation Score (Raman) 0.788111