CID 45055096

2-(2-(3-(allyloxy)benzylidene)hydrazino)-n-(2-chlorophenyl)-2-oxoacetamide

Structural Information

Molecular Formula
C18H16ClN3O3
SMILES
C=CCOC1=CC=CC(=C1)/C=N/NC(=O)C(=O)NC2=CC=CC=C2Cl
InChI
InChI=1S/C18H16ClN3O3/c1-2-10-25-14-7-5-6-13(11-14)12-20-22-18(24)17(23)21-16-9-4-3-8-15(16)19/h2-9,11-12H,1,10H2,(H,21,23)(H,22,24)/b20-12+
InChIKey
VPGJZVYACGOHCA-UDWIEESQSA-N
Compound name
N-(2-chlorophenyl)-N'-[(E)-(3-prop-2-enoxyphenyl)methylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.088 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.09528 183.5
[M+Na]+ 380.07722 189.4
[M-H]- 356.08072 191.2
[M+NH4]+ 375.12182 196.6
[M+K]+ 396.05116 184.2
[M+H-H2O]+ 340.08526 175.0
[M+HCOO]- 402.08620 206.0
[M+CH3COO]- 416.10185 219.7
[M+Na-2H]- 378.06267 186.7
[M]+ 357.08745 186.8
[M]- 357.08855 186.8
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.