CID 1243054

825658-06-8

Structural Information

Molecular Formula
C15H14Cl2N2O3S
SMILES
CS(=O)(=O)NC1=CC=C(C=C1)C(=O)NCC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C15H14Cl2N2O3S/c1-23(21,22)19-13-6-3-10(4-7-13)15(20)18-9-11-2-5-12(16)8-14(11)17/h2-8,19H,9H2,1H3,(H,18,20)
InChIKey
RDFIQTZRJRVFHK-UHFFFAOYSA-N
Compound name
N-[(2,4-dichlorophenyl)methyl]-4-(methanesulfonamido)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

372.01022 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.01750 179.6
[M+Na]+ 394.99944 188.2
[M-H]- 371.00294 186.4
[M+NH4]+ 390.04404 193.3
[M+K]+ 410.97338 181.4
[M+H-H2O]+ 355.00748 174.0
[M+HCOO]- 417.00842 189.5
[M+CH3COO]- 431.02407 214.4
[M+Na-2H]- 392.98489 182.1
[M]+ 372.00967 185.4
[M]- 372.01077 185.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe