CID 345790

N-(4-methoxyphenyl)benzenesulfonamide

Structural Information

Molecular Formula
C13H13NO3S
SMILES
COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2
InChI
InChI=1S/C13H13NO3S/c1-17-12-9-7-11(8-10-12)14-18(15,16)13-5-3-2-4-6-13/h2-10,14H,1H3
InChIKey
UZUQLWPXATZCDY-UHFFFAOYSA-N
Compound name
N-(4-methoxyphenyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

36
Patents

263.0616 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.06888 156.2
[M+Na]+ 286.05082 164.1
[M-H]- 262.05432 163.2
[M+NH4]+ 281.09542 172.7
[M+K]+ 302.02476 160.2
[M+H-H2O]+ 246.05886 148.9
[M+HCOO]- 308.05980 176.2
[M+CH3COO]- 322.07545 193.8
[M+Na-2H]- 284.03627 162.3
[M]+ 263.06105 159.0
[M]- 263.06215 159.0
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