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Chrysene
SpectraBase Compound ID IXnlbTmFD0f
InChI InChI=1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H
InChIKey WDECIBYCCFPHNR-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C18H12
Exact Mass 228.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9dYMSbuCXN
Name Chrysene
CAS Registry Number 218-01-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12
InChI InChI=1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H
InChIKey WDECIBYCCFPHNR-UHFFFAOYSA-N
Molecular Weight 228.294 g/mol
SMILES c12c(c3ccccc3cc2)ccc2c1cccc2
SPLASH splash10-004i-1290000000-56140205b86bbc0384c9
Source of Spectrum JZ-1992-1910-0
Synonyms 1,2,5,6-Dibenzonaphthalene 1,2-Benzophenanthrene Benz(a)phenanthrene Benzo[a]phenanthrene Benz[a]phenanthrene Chrysen Coal tar pitch volatiles: Chrysene AI3-00867 CCRIS 161 EINECS 205-923-4 HSDB 2810 NSC 6175 RCRA WASTE NO. U050
Wiley ID 1230384