CID 2755668

N-benzylidene-4-methylbenzenesulfonamide

Structural Information

Molecular Formula
C14H13NO2S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N=CC2=CC=CC=C2
InChI
InChI=1S/C14H13NO2S/c1-12-7-9-14(10-8-12)18(16,17)15-11-13-5-3-2-4-6-13/h2-11H,1H3
InChIKey
HVCKVBQOKOFBFH-UHFFFAOYSA-N
Compound name
N-benzylidene-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

77
Patents

259.0667 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.07398 157.3
[M+Na]+ 282.05592 171.2
[M+NH4]+ 277.10052 165.9
[M+K]+ 298.02986 161.6
[M-H]- 258.05942 162.0
[M+Na-2H]- 280.04137 167.0
[M]+ 259.06615 161.2
[M]- 259.06725 161.2
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