CID 215239

35285-70-2

Structural Information

Molecular Formula
C13H13N3O3S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C2=CC=NC=C2
InChI
InChI=1S/C13H13N3O3S/c1-10-2-4-12(5-3-10)20(18,19)16-15-13(17)11-6-8-14-9-7-11/h2-9,16H,1H3,(H,15,17)
InChIKey
PSUJEUSCHQUVEU-UHFFFAOYSA-N
Compound name
N'-(4-methylphenyl)sulfonylpyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

291.06775 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.07503 162.9
[M+Na]+ 314.05697 173.9
[M+NH4]+ 309.10157 169.1
[M+K]+ 330.03091 167.0
[M-H]- 290.06047 165.7
[M+Na-2H]- 312.04242 170.8
[M]+ 291.06720 165.4
[M]- 291.06830 165.4
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

No patent data available for this compound.