CID 163424

84812-61-3

Structural Information

Molecular Formula
C17H17N5O4S
SMILES
CC1=CC(=C(C=C1S(=O)(=O)N)O)N=NC2=C(NN(C2=O)C3=CC=CC=C3)C
InChI
InChI=1S/C17H17N5O4S/c1-10-8-13(14(23)9-15(10)27(18,25)26)19-20-16-11(2)21-22(17(16)24)12-6-4-3-5-7-12/h3-9,21,23H,1-2H3,(H2,18,25,26)
InChIKey
APJGXFJNLSFFMS-UHFFFAOYSA-N
Compound name
5-hydroxy-2-methyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

387.10013 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.10741 189.3
[M+Na]+ 410.08935 200.1
[M+NH4]+ 405.13395 193.4
[M+K]+ 426.06329 195.9
[M-H]- 386.09285 193.0
[M+Na-2H]- 408.07480 195.9
[M]+ 387.09958 191.9
[M]- 387.10068 191.9
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.