CID 2114013

1-(4-chlorophenyl)-4-hydroxy-1h-pyrazole-3-carbohydrazide

Structural Information

Molecular Formula
C10H9ClN4O2
SMILES
C1=CC(=CC=C1N2C=C(C(=N2)C(=O)NN)O)Cl
InChI
InChI=1S/C10H9ClN4O2/c11-6-1-3-7(4-2-6)15-5-8(16)9(14-15)10(17)13-12/h1-5,16H,12H2,(H,13,17)
InChIKey
BOXSGZRAFPBQHN-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-4-hydroxypyrazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

252.0414 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.04868 152.7
[M+Na]+ 275.03062 162.1
[M-H]- 251.03412 156.0
[M+NH4]+ 270.07522 168.4
[M+K]+ 291.00456 157.1
[M+H-H2O]+ 235.03866 145.2
[M+HCOO]- 297.03960 171.5
[M+CH3COO]- 311.05525 193.0
[M+Na-2H]- 273.01607 156.0
[M]+ 252.04085 152.6
[M]- 252.04195 152.6
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

No patent data available for this compound.