CID 6864981

3-(2-ethoxyphenyl)-n'-(4-isopropylbenzylidene)-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C22H24N4O2
SMILES
CCOC1=CC=CC=C1C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)C(C)C
InChI
InChI=1S/C22H24N4O2/c1-4-28-21-8-6-5-7-18(21)19-13-20(25-24-19)22(27)26-23-14-16-9-11-17(12-10-16)15(2)3/h5-15H,4H2,1-3H3,(H,24,25)(H,26,27)/b23-14+
InChIKey
VWFZDLQVHZVVSM-OEAKJJBVSA-N
Compound name
3-(2-ethoxyphenyl)-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

376.1899 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.19718 192.1
[M+Na]+ 399.17912 197.0
[M-H]- 375.18262 199.3
[M+NH4]+ 394.22372 202.0
[M+K]+ 415.15306 191.6
[M+H-H2O]+ 359.18716 181.1
[M+HCOO]- 421.18810 214.0
[M+CH3COO]- 435.20375 223.4
[M+Na-2H]- 397.16457 192.5
[M]+ 376.18935 192.9
[M]- 376.19045 192.9
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.