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6-Nitrochrysene

View entire compound with spectra: 3 NMR, 1 FTIR, and 4 MS (GC)

6-Nitrochrysene
SpectraBase Compound ID 7EG7hwJEKdd
InChI InChI=1S/C18H11NO2/c20-19(21)18-11-17-13-6-2-1-5-12(13)9-10-15(17)14-7-3-4-8-16(14)18/h1-11H
InChIKey UAWLTQJFZUYROA-UHFFFAOYSA-N
Mol Weight 273.29 g/mol
Molecular Formula C18H11NO2
Exact Mass 273.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MK1mCorUPN
Name 4-Nitrochrysene
Alternate Name(s) 6-Nitro-chrysene 6-Nitrochrysene Chrysene, 6-nitro- BRN 2134652 CCRIS 2975 NSC 407609
CAS Registry Number 7496-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11NO2
InChI InChI=1S/C18H11NO2/c20-19(21)18-11-17-13-6-2-1-5-12(13)9-10-15(17)14-7-3-4-8-16(14)18/h1-11H
InChIKey UAWLTQJFZUYROA-UHFFFAOYSA-N
Molecular Weight 273.291 g/mol
SMILES c1(N(=O)=O)cc2c3c(cccc3)ccc2c2c1cccc2
SPLASH splash10-0200-1490000000-2fe7451de91c19f3e4ef
Source of Spectrum W6-1989-35718-29818
Wiley ID 139435