CID 3764937

4-chloro-n-(3-chloro-1-phenylpropyl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C15H15Cl2NO2S
SMILES
C1=CC=C(C=C1)C(CCCl)NS(=O)(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C15H15Cl2NO2S/c16-11-10-15(12-4-2-1-3-5-12)18-21(19,20)14-8-6-13(17)7-9-14/h1-9,15,18H,10-11H2
InChIKey
DNBBOVLOJJLSAW-UHFFFAOYSA-N
Compound name
4-chloro-N-(3-chloro-1-phenylpropyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.02005 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.02733 172.8
[M+Na]+ 366.00927 180.7
[M-H]- 342.01277 179.1
[M+NH4]+ 361.05387 187.6
[M+K]+ 381.98321 173.6
[M+H-H2O]+ 326.01731 167.2
[M+HCOO]- 388.01825 181.5
[M+CH3COO]- 402.03390 206.4
[M+Na-2H]- 363.99472 175.8
[M]+ 343.01950 177.9
[M]- 343.02060 177.9
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.