CID 2727853

1h-indazole-3-carbohydrazide hydrochloride

Structural Information

Molecular Formula
C8H8N4O
SMILES
C1=CC=C2C(=C1)C(=NN2)C(=O)NN
InChI
InChI=1S/C8H8N4O/c9-10-8(13)7-5-3-1-2-4-6(5)11-12-7/h1-4H,9H2,(H,10,13)(H,11,12)
InChIKey
JOUPSJAGJHYWLM-UHFFFAOYSA-N
Compound name
1H-indazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

57
Patents

176.06981 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.077086 133.0
[M+Na]+ 199.059028 142.1
[M-H]- 175.062534 134.0
[M+NH4]+ 194.103633 151.9
[M+K]+ 215.032968 138.4
[M+H-H2O]+ 159.067070 125.8
[M+HCOO]- 221.068011 156.8
[M+CH3COO]- 235.083661 146.0
[M+Na-2H]- 197.044476 141.1
[M]+ 176.06926142 130.8
[M]- 176.07035858 130.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe