CID 2785819

Nsc681261

Structural Information

Molecular Formula
C9H6N4O
SMILES
C1=CC=C2C(=C1)C(=CC(=O)N2)N=[N+]=[N-]
InChI
InChI=1S/C9H6N4O/c10-13-12-8-5-9(14)11-7-4-2-1-3-6(7)8/h1-5H,(H,11,14)
InChIKey
BYZRVFGVANYGRC-UHFFFAOYSA-N
Compound name
4-azido-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.05415 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.06143 131.7
[M+Na]+ 209.04337 140.6
[M-H]- 185.04687 136.9
[M+NH4]+ 204.08797 150.7
[M+K]+ 225.01731 132.5
[M+H-H2O]+ 169.05141 128.9
[M+HCOO]- 231.05235 160.6
[M+CH3COO]- 245.06800 182.0
[M+Na-2H]- 207.02882 145.4
[M]+ 186.05360 128.6
[M]- 186.05470 128.6
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.