CID 515944

1-(2-amino-5-chloro-phenyl)sulfonylpyrrole-2-carbohydrazide

Structural Information

Molecular Formula
C11H11ClN4O3S
SMILES
C1=CN(C(=C1)C(=O)NN)S(=O)(=O)C2=C(C=CC(=C2)Cl)N
InChI
InChI=1S/C11H11ClN4O3S/c12-7-3-4-8(13)10(6-7)20(18,19)16-5-1-2-9(16)11(17)15-14/h1-6H,13-14H2,(H,15,17)
InChIKey
OGDQZZNHOPLHMM-UHFFFAOYSA-N
Compound name
1-(2-amino-5-chlorophenyl)sulfonylpyrrole-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

314.02405 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.03133 167.9
[M+Na]+ 337.01327 177.0
[M-H]- 313.01677 173.7
[M+NH4]+ 332.05787 183.0
[M+K]+ 352.98721 171.5
[M+H-H2O]+ 297.02131 161.5
[M+HCOO]- 359.02225 183.2
[M+CH3COO]- 373.03790 205.2
[M+Na-2H]- 334.99872 169.3
[M]+ 314.02350 169.5
[M]- 314.02460 169.5
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.