CID 9612606

357207-76-2

Structural Information

Molecular Formula
C19H19N3O3
SMILES
CC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CC(=CC=C2)OCC=C
InChI
InChI=1S/C19H19N3O3/c1-3-11-25-17-6-4-5-15(12-17)13-20-22-19(24)18(23)21-16-9-7-14(2)8-10-16/h3-10,12-13H,1,11H2,2H3,(H,21,23)(H,22,24)/b20-13+
InChIKey
XKTVDACWEATPNJ-DEDYPNTBSA-N
Compound name
N-(4-methylphenyl)-N'-[(E)-(3-prop-2-enoxyphenyl)methylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.14264 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.149916 180.3
[M+Na]+ 360.131858 184.9
[M-H]- 336.135364 188.0
[M+NH4]+ 355.176463 193.2
[M+K]+ 376.105798 181.3
[M+H-H2O]+ 320.139900 170.7
[M+HCOO]- 382.140841 206.9
[M+CH3COO]- 396.156491 219.1
[M+Na-2H]- 358.117306 183.6
[M]+ 337.14209142 181.5
[M]- 337.14318858 181.5
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.