CID 99907772

881664-68-2

Structural Information

Molecular Formula
C19H19N3O2
SMILES
CC1=CC(=CC=C1)NC(=O)C(=O)N/N=C/C(=C/C2=CC=CC=C2)/C
InChI
InChI=1S/C19H19N3O2/c1-14-7-6-10-17(12-14)21-18(23)19(24)22-20-13-15(2)11-16-8-4-3-5-9-16/h3-13H,1-2H3,(H,21,23)(H,22,24)/b15-11+,20-13+
InChIKey
LABSNYRNCIPUOR-JPGHCFAASA-N
Compound name
N-(3-methylphenyl)-N'-[(E)-[(E)-2-methyl-3-phenylprop-2-enylidene]amino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.14774 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.15502 178.2
[M+Na]+ 344.13696 181.9
[M-H]- 320.14046 185.6
[M+NH4]+ 339.18156 191.6
[M+K]+ 360.11090 178.1
[M+H-H2O]+ 304.14500 168.9
[M+HCOO]- 366.14594 203.7
[M+CH3COO]- 380.16159 215.9
[M+Na-2H]- 342.12241 180.9
[M]+ 321.14719 176.9
[M]- 321.14829 176.9
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.