CID 99612

2-nitro-9h-carbazole

Structural Information

Molecular Formula
C12H8N2O2
SMILES
C1=CC=C2C(=C1)C3=C(N2)C=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C12H8N2O2/c15-14(16)8-5-6-10-9-3-1-2-4-11(9)13-12(10)7-8/h1-7,13H
InChIKey
RSSFRJAJZYDBDI-UHFFFAOYSA-N
Compound name
2-nitro-9H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

48
Patents

212.05858 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.06586 140.5
[M+Na]+ 235.04780 149.9
[M-H]- 211.05130 144.3
[M+NH4]+ 230.09240 160.3
[M+K]+ 251.02174 141.1
[M+H-H2O]+ 195.05584 138.6
[M+HCOO]- 257.05678 164.2
[M+CH3COO]- 271.07243 178.9
[M+Na-2H]- 233.03325 151.2
[M]+ 212.05803 139.5
[M]- 212.05913 139.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.