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6-Hydroxybenzo(a)pyrene

View entire compound with spectra: 1 MS (GC)

6-Hydroxybenzo(a)pyrene
SpectraBase Compound ID 6MzOVWZmJog
InChI InChI=1S/C20H12O/c21-20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-11,21H
InChIKey MGTMTTGZMPDIQS-UHFFFAOYSA-N
Mol Weight 268.31 g/mol
Molecular Formula C20H12O
Exact Mass 268.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeBsE5B7hEZ
Name 6-Hydroxybenzo(a)pyrene
Alternate Name(s) 6-Benzo[b]pyrenol benzo[b]pyren-6-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12O
InChI InChI=1S/C20H12O/c21-20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-11,21H
InChIKey MGTMTTGZMPDIQS-UHFFFAOYSA-N
Molecular Weight 268.315 g/mol
SMILES Oc1c2c3c(c4c1cccc4)ccc1c3c(cc2)ccc1
SPLASH splash10-014i-0090000000-30b14840bebc44b25984
Source of Spectrum D3-1980-998-32
Wiley ID 1272837