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Benzo[e]pyrene

View entire compound with spectra: 3 NMR, 2 FTIR, 1 UV-Vis, and 7 MS (GC)

Benzo[e]pyrene
SpectraBase Compound ID FsCQNSJzzJA
InChI InChI=1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H
InChIKey TXVHTIQJNYSSKO-UHFFFAOYSA-N
Mol Weight 252.32 g/mol
Molecular Formula C20H12
Exact Mass 252.0939 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID bLcOu3wxdk
Name Benzo[e]pyrene
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number B10102
CAS Registry Number 192-97-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12
InChI InChI=1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H
InChIKey TXVHTIQJNYSSKO-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1,2-Benzpyrene 4,5-Benzpyrene
Wiley ID SIAL_13CNMR_010792