CID 4143033

5-amino-1-(4-bromophenyl)-1h-pyrazole-4-carbohydrazide

Structural Information

Molecular Formula
C10H10BrN5O
SMILES
C1=CC(=CC=C1N2C(=C(C=N2)C(=O)NN)N)Br
InChI
InChI=1S/C10H10BrN5O/c11-6-1-3-7(4-2-6)16-9(12)8(5-14-16)10(17)15-13/h1-5H,12-13H2,(H,15,17)
InChIKey
XKCCKDRUAISHDI-UHFFFAOYSA-N
Compound name
5-amino-1-(4-bromophenyl)pyrazole-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.00687 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.01415 154.8
[M+Na]+ 317.99609 165.6
[M-H]- 293.99959 161.4
[M+NH4]+ 313.04069 171.6
[M+K]+ 333.97003 153.1
[M+H-H2O]+ 278.00413 151.3
[M+HCOO]- 340.00507 177.2
[M+CH3COO]- 354.02072 203.2
[M+Na-2H]- 315.98154 159.5
[M]+ 295.00632 169.9
[M]- 295.00742 169.9
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.