CID 210046

20884-81-5

Structural Information

Molecular Formula
C16H15Cl2NO3S
SMILES
CC(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C16H15Cl2NO3S/c1-10(2)23(21,22)13-6-3-11(4-7-13)16(20)19-12-5-8-14(17)15(18)9-12/h3-10H,1-2H3,(H,19,20)
InChIKey
WOGAJWIGDGPEAM-UHFFFAOYSA-N
Compound name
N-(3,4-dichlorophenyl)-4-propan-2-ylsulfonylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.01498 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.02226 177.9
[M+Na]+ 394.00420 186.7
[M-H]- 370.00770 184.9
[M+NH4]+ 389.04880 192.0
[M+K]+ 409.97814 180.3
[M+H-H2O]+ 354.01224 172.7
[M+HCOO]- 416.01318 185.6
[M+CH3COO]- 430.02883 213.1
[M+Na-2H]- 391.98965 178.5
[M]+ 371.01443 184.3
[M]- 371.01553 184.3
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.