CID 4584276

N-(3,4-dimethoxybenzyl)benzenesulfonamide

Structural Information

Molecular Formula
C15H17NO4S
SMILES
COC1=C(C=C(C=C1)CNS(=O)(=O)C2=CC=CC=C2)OC
InChI
InChI=1S/C15H17NO4S/c1-19-14-9-8-12(10-15(14)20-2)11-16-21(17,18)13-6-4-3-5-7-13/h3-10,16H,11H2,1-2H3
InChIKey
YLXLNLAJPGHVPS-UHFFFAOYSA-N
Compound name
N-[(3,4-dimethoxyphenyl)methyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

307.08783 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.09511 168.6
[M+Na]+ 330.07705 181.0
[M+NH4]+ 325.12165 175.8
[M+K]+ 346.05099 172.9
[M-H]- 306.08055 172.0
[M+Na-2H]- 328.06250 176.5
[M]+ 307.08728 171.8
[M]- 307.08838 171.8
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

patents stripe