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7-Methylbenzo[a]pyrene
SpectraBase Compound ID BsewEmDWHv7
InChI InChI=1S/C21H14/c1-13-4-2-7-17-18-11-10-15-6-3-5-14-8-9-16(12-19(13)17)21(18)20(14)15/h2-12H,1H3
InChIKey PYVWGNPFWVQISD-UHFFFAOYSA-N
Mol Weight 266.34 g/mol
Molecular Formula C21H14
Exact Mass 266.10955 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DREp2i2L7ld
Name 7-Methylbenzo[a]pyrene
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 380903
CAS Registry Number 63041-77-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14
InChI InChI=1S/C21H14/c1-13-4-2-7-17-18-11-10-15-6-3-5-14-8-9-16(12-19(13)17)21(18)20(14)15/h2-12H,1H3
InChIKey PYVWGNPFWVQISD-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_008195