CID 86458

Benzenesulfonamide, 4-amino-3,5-dichloro-n-ethyl-2-methyl-

Structural Information

Molecular Formula
C9H12Cl2N2O2S
SMILES
CCNS(=O)(=O)C1=CC(=C(C(=C1C)Cl)N)Cl
InChI
InChI=1S/C9H12Cl2N2O2S/c1-3-13-16(14,15)7-4-6(10)9(12)8(11)5(7)2/h4,13H,3,12H2,1-2H3
InChIKey
SBBHTEMLRJJIGK-UHFFFAOYSA-N
Compound name
4-amino-3,5-dichloro-N-ethyl-2-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

281.99966 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.00694 157.2
[M+Na]+ 304.98888 167.7
[M-H]- 280.99238 161.0
[M+NH4]+ 300.03348 174.9
[M+K]+ 320.96282 161.4
[M+H-H2O]+ 264.99692 153.7
[M+HCOO]- 326.99786 167.1
[M+CH3COO]- 341.01351 200.1
[M+Na-2H]- 302.97433 158.6
[M]+ 281.99911 161.8
[M]- 282.00021 161.8
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.