CID 6009259

Mesitylenesulfonic benzylidenehydrazide

Structural Information

Molecular Formula
C16H18N2O2S
SMILES
CC1=CC(=C(C(=C1)C)S(=O)(=O)N/N=C\C2=CC=CC=C2)C
InChI
InChI=1S/C16H18N2O2S/c1-12-9-13(2)16(14(3)10-12)21(19,20)18-17-11-15-7-5-4-6-8-15/h4-11,18H,1-3H3/b17-11-
InChIKey
UZISGOKGIUQLLS-BOPFTXTBSA-N
Compound name
N-[(Z)-benzylideneamino]-2,4,6-trimethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.1089 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.116176 168.9
[M+Na]+ 325.098118 177.3
[M-H]- 301.101624 177.5
[M+NH4]+ 320.142723 184.8
[M+K]+ 341.072058 172.3
[M+H-H2O]+ 285.106160 160.9
[M+HCOO]- 347.107101 190.2
[M+CH3COO]- 361.122751 209.0
[M+Na-2H]- 323.083566 173.0
[M]+ 302.10835142 172.5
[M]- 302.10944858 172.5
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.