CID 109487

Dtxsid701340404

Structural Information

Molecular Formula
C16H15N5O4S
SMILES
CC1=C(C(=O)N(N1)C2=CC=CC=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)N)O
InChI
InChI=1S/C16H15N5O4S/c1-10-15(16(23)21(20-10)11-5-3-2-4-6-11)19-18-13-9-12(26(17,24)25)7-8-14(13)22/h2-9,20,22H,1H3,(H2,17,24,25)
InChIKey
GCFVPDSCNABJRU-UHFFFAOYSA-N
Compound name
4-hydroxy-3-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4
Patents

373.08447 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.09175 184.0
[M+Na]+ 396.07369 194.8
[M+NH4]+ 391.11829 188.4
[M+K]+ 412.04763 190.5
[M-H]- 372.07719 187.7
[M+Na-2H]- 394.05914 191.2
[M]+ 373.08392 186.6
[M]- 373.08502 186.6
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

patents stripe