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]+ 358.095276 183.5
[M+Na]+ 380.077218 189.4
[M-H]- 356.080724 191.2
[M+NH4]+ 375.121823 196.6
[M+K]+ 396.051158 184.2
[M+H-H2O]+ 340.085260 175.0
[M+HCOO]- 402.086201 206.0
[M+CH3COO]- 416.101851 219.7
[M+Na-2H]- 378.062666 186.7
[M]+ 357.08745142 186.8
[M]- 357.08854858 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.