CID 6867824

N'-[(e)-(3,4-dimethoxyphenyl)methylidene]-3-(4-isopropoxy-3-methoxyphenyl)-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C23H26N4O5
SMILES
CC(C)OC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC(=C(C=C3)OC)OC)OC
InChI
InChI=1S/C23H26N4O5/c1-14(2)32-20-9-7-16(11-22(20)31-5)17-12-18(26-25-17)23(28)27-24-13-15-6-8-19(29-3)21(10-15)30-4/h6-14H,1-5H3,(H,25,26)(H,27,28)/b24-13+
InChIKey
GMKHQWRYJMDOHL-ZMOGYAJESA-N
Compound name
N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-(3-methoxy-4-propan-2-yloxyphenyl)-1H-pyrazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

438.1903 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.19758 204.6
[M+Na]+ 461.17952 210.0
[M-H]- 437.18302 212.4
[M+NH4]+ 456.22412 212.1
[M+K]+ 477.15346 206.9
[M+H-H2O]+ 421.18756 193.4
[M+HCOO]- 483.18850 226.6
[M+CH3COO]- 497.20415 235.5
[M+Na-2H]- 459.16497 203.6
[M]+ 438.18975 210.7
[M]- 438.19085 210.7
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.