CID 51060836

N-(4-cl-ph)-2-(2-(2-methyl-3-phenyl-2-propenylidene)hydrazino)-2-oxoacetamide

Structural Information

Molecular Formula
C18H16ClN3O2
SMILES
C/C(=C/C1=CC=CC=C1)/C=N/NC(=O)C(=O)NC2=CC=C(C=C2)Cl
InChI
InChI=1S/C18H16ClN3O2/c1-13(11-14-5-3-2-4-6-14)12-20-22-18(24)17(23)21-16-9-7-15(19)8-10-16/h2-12H,1H3,(H,21,23)(H,22,24)/b13-11-,20-12+
InChIKey
VZBBXFPZUJKQNT-XKSGRZMBSA-N
Compound name
N-(4-chlorophenyl)-N'-[(E)-[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.0931 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.10038 181.4
[M+Na]+ 364.08232 186.3
[M-H]- 340.08582 188.8
[M+NH4]+ 359.12692 194.9
[M+K]+ 380.05626 180.9
[M+H-H2O]+ 324.09036 173.1
[M+HCOO]- 386.09130 202.7
[M+CH3COO]- 400.10695 216.5
[M+Na-2H]- 362.06777 184.0
[M]+ 341.09255 182.2
[M]- 341.09365 182.2
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.