CID 13774010

4-(2,5-dioxo-1-pyrrolidinyl)benzenesulfonyl azide

Structural Information

Molecular Formula
C10H8N4O4S
SMILES
C1CC(=O)N(C1=O)C2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-]
InChI
InChI=1S/C10H8N4O4S/c11-12-13-19(17,18)8-3-1-7(2-4-8)14-9(15)5-6-10(14)16/h1-4H,5-6H2
InChIKey
LDXPAIAZUCTWQL-UHFFFAOYSA-N
Compound name
N-diazo-4-(2,5-dioxopyrrolidin-1-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

280.0266 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.03388 158.7
[M+Na]+ 303.01582 166.6
[M-H]- 279.01932 167.4
[M+NH4]+ 298.06042 175.2
[M+K]+ 318.98976 158.7
[M+H-H2O]+ 263.02386 155.5
[M+HCOO]- 325.02480 182.2
[M+CH3COO]- 339.04045 195.1
[M+Na-2H]- 301.00127 165.7
[M]+ 280.02605 157.4
[M]- 280.02715 157.4
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

patents stripe