CID 2755281

(4-nitrophenyl)methanesulfonamide

Structural Information

Molecular Formula
C7H8N2O4S
SMILES
C1=CC(=CC=C1CS(=O)(=O)N)[N+](=O)[O-]
InChI
InChI=1S/C7H8N2O4S/c8-14(12,13)5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2,(H2,8,12,13)
InChIKey
VYLIVAAMSLPRIS-UHFFFAOYSA-N
Compound name
(4-nitrophenyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

150
Patents

216.02048 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.02776 138.9
[M+Na]+ 239.00970 149.6
[M+NH4]+ 234.05430 145.9
[M+K]+ 254.98364 146.6
[M-H]- 215.01320 140.8
[M+Na-2H]- 236.99515 144.1
[M]+ 216.01993 141.1
[M]- 216.02103 141.1
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