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Benz[e]acephenanthrylen-12-ol
SpectraBase Compound ID 3SgCNJKcM3M
InChI InChI=1S/C20H12O/c21-18-10-3-5-12-11-17-14-7-2-1-6-13(14)15-8-4-9-16(19(12)18)20(15)17/h1-11,21H
InChIKey UJJTWHNUFDJUQO-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 jpPu9f87Tt
Name Benz[e]acephenanthrylen-12-ol
CAS Registry Number 100516-09-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12O
InChI InChI=1S/C20H12O/c21-18-10-3-5-12-11-17-14-7-2-1-6-13(14)15-8-4-9-16(19(12)18)20(15)17/h1-11,21H
InChIKey UJJTWHNUFDJUQO-UHFFFAOYSA-N
Molecular Weight 268.315 g/mol
SMILES Oc1c2c3c4c(-c5ccccc5-c4ccc3)cc2ccc1
SPLASH splash10-014i-0090000000-152743ec1b1f6a79d63b
Source of Spectrum J-51-1211-12
Synonyms 12-Hydroxy-bbf benzo[e]acephenanthrylen-12-ol
Wiley ID 1272846