CID 508490

2-(1h-6-indazolylamino)-6-methyl-n-(2-pyridyl)-3-pyridinecarbohydrazide

Structural Information

Molecular Formula
C19H18N7O
SMILES
CC1=[N+](C(=C(C=C1)C(=O)NN)NC2=CC3=C(C=C2)C=NN3)C4=CC=CC=N4
InChI
InChI=1S/C19H17N7O/c1-12-5-8-15(19(27)24-20)18(26(12)17-4-2-3-9-21-17)23-14-7-6-13-11-22-25-16(13)10-14/h2-11H,20H2,1H3,(H2,22,24,25,27)/p+1
InChIKey
AUTVSCCELRKTAV-UHFFFAOYSA-O
Compound name
2-(1H-indazol-6-ylamino)-6-methyl-1-pyridin-2-ylpyridin-1-ium-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.1573 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.16458 182.0
[M+Na]+ 383.14652 189.8
[M-H]- 359.15002 187.5
[M+NH4]+ 378.19112 189.6
[M+K]+ 399.12046 176.6
[M+H-H2O]+ 343.15456 173.3
[M+HCOO]- 405.15550 202.5
[M+CH3COO]- 419.17115 212.7
[M+Na-2H]- 381.13197 191.2
[M]+ 360.15675 179.1
[M]- 360.15785 179.1
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.