CID 820058

N'-cyclopentylidene-3-phenyl-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C15H16N4O
SMILES
C1CCC(=NNC(=O)C2=CC(=NN2)C3=CC=CC=C3)C1
InChI
InChI=1S/C15H16N4O/c20-15(19-16-12-8-4-5-9-12)14-10-13(17-18-14)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,17,18)(H,19,20)
InChIKey
IABHZYFXUKMTDT-UHFFFAOYSA-N
Compound name
N-(cyclopentylideneamino)-3-phenyl-1H-pyrazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

268.13242 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.13970 159.8
[M+Na]+ 291.12164 164.4
[M-H]- 267.12514 166.9
[M+NH4]+ 286.16624 175.6
[M+K]+ 307.09558 160.3
[M+H-H2O]+ 251.12968 150.1
[M+HCOO]- 313.13062 183.1
[M+CH3COO]- 327.14627 170.7
[M+Na-2H]- 289.10709 161.9
[M]+ 268.13187 154.9
[M]- 268.13297 154.9
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.