CID 5706325

N-(4-methoxybenzylidene)-4-methylbenzenesulfonamide

Structural Information

Molecular Formula
C15H15NO3S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)/N=C/C2=CC=C(C=C2)OC
InChI
InChI=1S/C15H15NO3S/c1-12-3-9-15(10-4-12)20(17,18)16-11-13-5-7-14(19-2)8-6-13/h3-11H,1-2H3/b16-11+
InChIKey
NMFPHUIOZBSQGW-LFIBNONCSA-N
Compound name
(NE)-N-[(4-methoxyphenyl)methylidene]-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

289.07727 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.084546 164.2
[M+Na]+ 312.066488 173.0
[M-H]- 288.069994 172.8
[M+NH4]+ 307.111093 180.8
[M+K]+ 328.040428 169.0
[M+H-H2O]+ 272.074530 156.5
[M+HCOO]- 334.075471 185.3
[M+CH3COO]- 348.091121 201.9
[M+Na-2H]- 310.051936 169.1
[M]+ 289.07672142 169.3
[M]- 289.07781858 169.3
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

No patent data available for this compound.