CID 135659464

N'-(4-hydroxybenzylidene)-3-isopropyl-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C14H16N4O2
SMILES
CC(C)C1=CC(=NN1)C(=O)N/N=C/C2=CC=C(C=C2)O
InChI
InChI=1S/C14H16N4O2/c1-9(2)12-7-13(17-16-12)14(20)18-15-8-10-3-5-11(19)6-4-10/h3-9,19H,1-2H3,(H,16,17)(H,18,20)/b15-8+
InChIKey
ZYEVYKVNKPVQNF-OVCLIPMQSA-N
Compound name
N-[(E)-(4-hydroxyphenyl)methylideneamino]-5-propan-2-yl-1H-pyrazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.12732 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.13460 162.9
[M+Na]+ 295.11654 168.9
[M-H]- 271.12004 166.1
[M+NH4]+ 290.16114 176.8
[M+K]+ 311.09048 165.0
[M+H-H2O]+ 255.12458 154.0
[M+HCOO]- 317.12552 184.9
[M+CH3COO]- 331.14117 200.0
[M+Na-2H]- 293.10199 165.3
[M]+ 272.12677 161.3
[M]- 272.12787 161.3
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.