CID 456825

N'-(3,4-dichlorophenyl)sulfonylacetohydrazide

Structural Information

Molecular Formula
C8H8Cl2N2O3S
SMILES
CC(=O)NNS(=O)(=O)C1=CC(=C(C=C1)Cl)Cl
InChI
InChI=1S/C8H8Cl2N2O3S/c1-5(13)11-12-16(14,15)6-2-3-7(9)8(10)4-6/h2-4,12H,1H3,(H,11,13)
InChIKey
APWBWYNMJLNHNQ-UHFFFAOYSA-N
Compound name
N'-(3,4-dichlorophenyl)sulfonylacetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.96326 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.97054 154.1
[M+Na]+ 304.95248 163.4
[M-H]- 280.95598 158.2
[M+NH4]+ 299.99708 171.4
[M+K]+ 320.92642 158.1
[M+H-H2O]+ 264.96052 150.4
[M+HCOO]- 326.96146 164.7
[M+CH3COO]- 340.97711 196.8
[M+Na-2H]- 302.93793 157.7
[M]+ 281.96271 158.9
[M]- 281.96381 158.9
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

No patent data available for this compound.