CID 9679514

3-(4-(benzyloxy)phenyl)-n'-(4-methylbenzylidene)-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C25H22N4O2
SMILES
CC1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)OCC4=CC=CC=C4
InChI
InChI=1S/C25H22N4O2/c1-18-7-9-19(10-8-18)16-26-29-25(30)24-15-23(27-28-24)21-11-13-22(14-12-21)31-17-20-5-3-2-4-6-20/h2-16H,17H2,1H3,(H,27,28)(H,29,30)/b26-16+
InChIKey
QMLRRZXQQCZLDN-WGOQTCKBSA-N
Compound name
N-[(E)-(4-methylphenyl)methylideneamino]-3-(4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

410.1743 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 411.18158 202.2
[M+Na]+ 433.16352 216.4
[M+NH4]+ 428.20812 208.4
[M+K]+ 449.13746 209.2
[M-H]- 409.16702 209.9
[M+Na-2H]- 431.14897 213.4
[M]+ 410.17375 206.3
[M]- 410.17485 206.3
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.

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No patent data available for this compound.