CID 223059

9-(2-nitrophenyl)carbazole

Structural Information

Molecular Formula
C18H12N2O2
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=CC=C4[N+](=O)[O-]
InChI
InChI=1S/C18H12N2O2/c21-20(22)18-12-6-5-11-17(18)19-15-9-3-1-7-13(15)14-8-2-4-10-16(14)19/h1-12H
InChIKey
PKJSBKDIIGBJLF-UHFFFAOYSA-N
Compound name
9-(2-nitrophenyl)carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

236
Patents

288.08987 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.09715 163.8
[M+Na]+ 311.07909 172.7
[M-H]- 287.08259 171.8
[M+NH4]+ 306.12369 180.7
[M+K]+ 327.05303 162.8
[M+H-H2O]+ 271.08713 159.6
[M+HCOO]- 333.08807 187.9
[M+CH3COO]- 347.10372 197.0
[M+Na-2H]- 309.06454 172.9
[M]+ 288.08932 164.2
[M]- 288.09042 164.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe