CID 19844126

4-hydrazinyl-n-phenylbenzene-1-sulfonamide hydrochloride

Structural Information

Molecular Formula
C12H13N3O2S
SMILES
C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NN
InChI
InChI=1S/C12H13N3O2S/c13-14-10-6-8-12(9-7-10)18(16,17)15-11-4-2-1-3-5-11/h1-9,14-15H,13H2
InChIKey
WVDBDJIZBHKYQY-UHFFFAOYSA-N
Compound name
4-hydrazinyl-N-phenylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

263.07285 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.080126 154.4
[M+Na]+ 286.062068 161.1
[M-H]- 262.065574 160.7
[M+NH4]+ 281.106673 169.9
[M+K]+ 302.036008 156.2
[M+H-H2O]+ 246.070110 146.6
[M+HCOO]- 308.071051 175.7
[M+CH3COO]- 322.086701 198.3
[M+Na-2H]- 284.047516 161.3
[M]+ 263.07230142 153.0
[M]- 263.07339858 153.0
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