CID 9627042

N-(4-ethylphenyl)-2-oxo-2-(2-(4-pyridinylmethylene)hydrazino)acetamide

Structural Information

Molecular Formula
C16H16N4O2
SMILES
CCC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CC=NC=C2
InChI
InChI=1S/C16H16N4O2/c1-2-12-3-5-14(6-4-12)19-15(21)16(22)20-18-11-13-7-9-17-10-8-13/h3-11H,2H2,1H3,(H,19,21)(H,20,22)/b18-11+
InChIKey
INMSMJFLRVJIKX-WOJGMQOQSA-N
Compound name
N-(4-ethylphenyl)-N'-[(E)-pyridin-4-ylmethylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.12732 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.134596 168.8
[M+Na]+ 319.116538 173.7
[M-H]- 295.120044 175.3
[M+NH4]+ 314.161143 182.0
[M+K]+ 335.090478 170.4
[M+H-H2O]+ 279.124580 158.9
[M+HCOO]- 341.125521 194.9
[M+CH3COO]- 355.141171 210.1
[M+Na-2H]- 317.101986 174.7
[M]+ 296.12677142 168.4
[M]- 296.12786858 168.4
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.