For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
9-Oxo-1,2,3,6,7,8-hexahydro-5-nitrocyclohexano[a]pyrene
SpectraBase Compound ID G829QrvDRQJ
InChI InChI=1S/C20H19NO3/c22-17-9-3-6-13-12-5-1-4-11-10-16(21(23)24)14-7-2-8-15(19(13)17)20(14)18(11)12/h10H,1-9H2
InChIKey LDYCEMRYSRLXOF-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HAPKgPyDaZU
Name 9-Oxo-1,2,3,6,7,8-hexahydro-5-nitrocyclohexano[a]pyrene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c22-17-9-3-6-13-12-5-1-4-11-10-16(21(23)24)14-7-2-8-15(19(13)17)20(14)18(11)12/h10H,1-9H2
InChIKey LDYCEMRYSRLXOF-UHFFFAOYSA-N
Molecular Weight 321.376 g/mol
SMILES c12c3c4CCCc3cc(N(=O)=O)c1CCCc2c1c4CCCC1=O
SPLASH splash10-00di-0029000000-2aa9b8adef695ddafc03
Source of Spectrum OP-27-599-7
Wiley ID 850640