CID 710732

2,5-dichloro-n-(4-methoxybenzyl)benzenesulfonamide

Structural Information

Molecular Formula
C14H13Cl2NO3S
SMILES
COC1=CC=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl
InChI
InChI=1S/C14H13Cl2NO3S/c1-20-12-5-2-10(3-6-12)9-17-21(18,19)14-8-11(15)4-7-13(14)16/h2-8,17H,9H2,1H3
InChIKey
GHAIDUUULQXGQP-UHFFFAOYSA-N
Compound name
2,5-dichloro-N-[(4-methoxyphenyl)methyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

344.99933 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.00661 175.8
[M+Na]+ 367.98855 190.5
[M+NH4]+ 363.03315 183.9
[M+K]+ 383.96249 180.5
[M-H]- 343.99205 179.6
[M+Na-2H]- 365.97400 183.8
[M]+ 344.99878 180.2
[M]- 344.99988 180.2
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.