CID 9660439

4-methyl-n'-(4-((4-methylbenzyl)oxy)benzylidene)benzenesulfonohydrazide

Structural Information

Molecular Formula
C22H22N2O3S
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NS(=O)(=O)C3=CC=C(C=C3)C
InChI
InChI=1S/C22H22N2O3S/c1-17-3-7-20(8-4-17)16-27-21-11-9-19(10-12-21)15-23-24-28(25,26)22-13-5-18(2)6-14-22/h3-15,24H,16H2,1-2H3/b23-15+
InChIKey
PBHMUNIUQFVLSJ-HZHRSRAPSA-N
Compound name
4-methyl-N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.1351 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.14238 194.1
[M+Na]+ 417.12432 201.0
[M-H]- 393.12782 205.0
[M+NH4]+ 412.16892 205.5
[M+K]+ 433.09826 195.0
[M+H-H2O]+ 377.13236 184.0
[M+HCOO]- 439.13330 215.0
[M+CH3COO]- 453.14895 225.1
[M+Na-2H]- 415.10977 198.2
[M]+ 394.13455 198.4
[M]- 394.13565 198.4
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

No patent data available for this compound.