CID 135547232

303108-10-3

Structural Information

Molecular Formula
C20H20N4O3
SMILES
CCOC1=CC=CC=C1C2=NNC(=C2)C(=O)N/N=C(\C)/C3=CC=C(C=C3)O
InChI
InChI=1S/C20H20N4O3/c1-3-27-19-7-5-4-6-16(19)17-12-18(23-22-17)20(26)24-21-13(2)14-8-10-15(25)11-9-14/h4-12,25H,3H2,1-2H3,(H,22,23)(H,24,26)/b21-13+
InChIKey
XHUAHBUGXKFJHL-FYJGNVAPSA-N
Compound name
3-(2-ethoxyphenyl)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]-1H-pyrazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.15353 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.16081 187.7
[M+Na]+ 387.14275 198.7
[M+NH4]+ 382.18735 192.6
[M+K]+ 403.11669 194.9
[M-H]- 363.14625 191.6
[M+Na-2H]- 385.12820 195.0
[M]+ 364.15298 190.0
[M]- 364.15408 190.0
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.