CID 135572067

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

Structural Information

Molecular Formula
C19H18N4O3
SMILES
CCOC1=CC=CC(=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)O
InChI
InChI=1S/C19H18N4O3/c1-2-26-16-5-3-4-14(10-16)17-11-18(22-21-17)19(25)23-20-12-13-6-8-15(24)9-7-13/h3-12,24H,2H2,1H3,(H,21,22)(H,23,25)/b20-12+
InChIKey
DWMTYZOKRHMIKP-UDWIEESQSA-N
Compound name
3-(3-ethoxyphenyl)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.13788 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.14516 180.7
[M+Na]+ 373.12710 186.7
[M-H]- 349.13060 187.1
[M+NH4]+ 368.17170 191.0
[M+K]+ 389.10104 181.3
[M+H-H2O]+ 333.13514 170.3
[M+HCOO]- 395.13608 203.4
[M+CH3COO]- 409.15173 213.6
[M+Na-2H]- 371.11255 183.7
[M]+ 350.13733 180.7
[M]- 350.13843 180.7
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.