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

*Links on SpectraBase are not permalinks.
(5aR,12aS)-7-Benzoyl-5-nitro-6,7,12,12a-tetrahydrochromeno[2,3-b]carbazol-13(5aH)-one
SpectraBase Compound ID 3CgQKKI5IYq
InChI InChI=1S/C26H18N2O5/c29-25-19-12-16(28(31)32)10-11-23(19)33-24-14-22-18(13-20(24)25)17-8-4-5-9-21(17)27(22)26(30)15-6-2-1-3-7-15/h1-12,20,24H,13-14H2/t20-,24+/m0/s1
InChIKey GAEWSADCEXKZFD-GBXCKJPGSA-N
Mol Weight 438.44 g/mol
Molecular Formula C26H18N2O5
Exact Mass 438.121572 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 475c67bSipf
Name (5aR,12aS)-7-Benzoyl-5-nitro-6,7,12,12a-tetrahydrochromeno[2,3-b]carbazol-13(5aH)-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H18N2O5
InChI InChI=1S/C26H18N2O5/c29-25-19-12-16(28(31)32)10-11-23(19)33-24-14-22-18(13-20(24)25)17-8-4-5-9-21(17)27(22)26(30)15-6-2-1-3-7-15/h1-12,20,24H,13-14H2/t20-,24+/m0/s1
InChIKey GAEWSADCEXKZFD-GBXCKJPGSA-N
Instrument Name VG TS-250 or Aligent 6890N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.e15
Molecular Weight 438.439 g/mol
SMILES [C@@]12(C(c3c(O[C@@]2(Cc2c(C1)c1c([n]2C(=O)c2ccccc2)cccc1)[H])ccc(c3)[N+]([O-])=O)=O)[H]
SPLASH splash10-0fb9-8930000000-7da7905df704972cf934
Source of Spectrum ARK-2008-151-7e
Wiley ID 1869199