CID 105524

Einecs 266-863-2

Structural Information

Molecular Formula
C16H20N4O3S
SMILES
CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)N(C)C)OC)N
InChI
InChI=1S/C16H20N4O3S/c1-11-9-14(17)16(23-4)10-15(11)19-18-12-5-7-13(8-6-12)24(21,22)20(2)3/h5-10H,17H2,1-4H3
InChIKey
DBZDIZIHYNYEMO-UHFFFAOYSA-N
Compound name
4-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]-N,N-dimethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.1256 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.13288 181.2
[M+Na]+ 371.11482 191.5
[M+NH4]+ 366.15942 187.5
[M+K]+ 387.08876 184.3
[M-H]- 347.11832 186.6
[M+Na-2H]- 369.10027 188.7
[M]+ 348.12505 184.4
[M]- 348.12615 184.4
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.