CID 137274583

72906-13-9

Structural Information

Molecular Formula
C16H14N6O3S
SMILES
CC1=C(C2=NC3=CC=CC=C3N2N1)N=NC4=C(C=CC(=C4)S(=O)(=O)N)O
InChI
InChI=1S/C16H14N6O3S/c1-9-15(16-18-11-4-2-3-5-13(11)22(16)21-9)20-19-12-8-10(26(17,24)25)6-7-14(12)23/h2-8,21,23H,1H3,(H2,17,24,25)
InChIKey
NZNBCZWCYDITER-UHFFFAOYSA-N
Compound name
4-hydroxy-3-[(2-methyl-1H-pyrazolo[1,5-a]benzimidazol-3-yl)diazenyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

370.0848 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.09208 182.7
[M+Na]+ 393.07402 195.7
[M-H]- 369.07752 190.1
[M+NH4]+ 388.11862 196.8
[M+K]+ 409.04796 189.8
[M+H-H2O]+ 353.08206 175.8
[M+HCOO]- 415.08300 203.4
[M+CH3COO]- 429.09865 194.5
[M+Na-2H]- 391.05947 189.1
[M]+ 370.08425 189.5
[M]- 370.08535 189.5
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.