CID 3558590

4-azidobenzenesulfonamide

Structural Information

Molecular Formula
C6H6N4O2S
SMILES
C1=CC(=CC=C1N=[N+]=[N-])S(=O)(=O)N
InChI
InChI=1S/C6H6N4O2S/c7-10-9-5-1-3-6(4-2-5)13(8,11)12/h1-4H,(H2,8,11,12)
InChIKey
UZEFHQIOSJWWSB-UHFFFAOYSA-N
Compound name
4-azidobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

345
Patents

198.02115 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.02843 133.8
[M+Na]+ 221.01037 141.5
[M-H]- 197.01387 140.1
[M+NH4]+ 216.05497 152.7
[M+K]+ 236.98431 134.2
[M+H-H2O]+ 181.01841 131.3
[M+HCOO]- 243.01935 159.9
[M+CH3COO]- 257.03500 183.5
[M+Na-2H]- 218.99582 143.8
[M]+ 198.02060 131.3
[M]- 198.02170 131.3
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