CID 16775810

N-(4-amino-2,6-dichlorophenyl)methanesulfonamide

Structural Information

Molecular Formula
C7H8Cl2N2O2S
SMILES
CS(=O)(=O)NC1=C(C=C(C=C1Cl)N)Cl
InChI
InChI=1S/C7H8Cl2N2O2S/c1-14(12,13)11-7-5(8)2-4(10)3-6(7)9/h2-3,11H,10H2,1H3
InChIKey
KWRHELJYMHGKNS-UHFFFAOYSA-N
Compound name
N-(4-amino-2,6-dichlorophenyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.96835 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.97563 148.4
[M+Na]+ 276.95757 159.0
[M-H]- 252.96107 152.3
[M+NH4]+ 272.00217 167.0
[M+K]+ 292.93151 153.1
[M+H-H2O]+ 236.96561 145.1
[M+HCOO]- 298.96655 159.1
[M+CH3COO]- 312.98220 193.0
[M+Na-2H]- 274.94302 151.5
[M]+ 253.96780 152.0
[M]- 253.96890 152.0
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

No patent data available for this compound.