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]+ 290.08455 164.2
[M+Na]+ 312.06649 173.0
[M-H]- 288.06999 172.8
[M+NH4]+ 307.11109 180.8
[M+K]+ 328.04043 169.0
[M+H-H2O]+ 272.07453 156.5
[M+HCOO]- 334.07547 185.3
[M+CH3COO]- 348.09112 201.9
[M+Na-2H]- 310.05194 169.1
[M]+ 289.07672 169.3
[M]- 289.07782 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.