CID 9627412

765303-50-2

Structural Information

Molecular Formula
C18H17N3O3
SMILES
COC1=CC=CC(=C1)NC(=O)C(=O)N/N=C/C=C/C2=CC=CC=C2
InChI
InChI=1S/C18H17N3O3/c1-24-16-11-5-10-15(13-16)20-17(22)18(23)21-19-12-6-9-14-7-3-2-4-8-14/h2-13H,1H3,(H,20,22)(H,21,23)/b9-6+,19-12+
InChIKey
SECKORNUXMIDOD-YKIVCEQRSA-N
Compound name
N-(3-methoxyphenyl)-N'-[(E)-[(E)-3-phenylprop-2-enylidene]amino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.12698 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.134256 175.8
[M+Na]+ 346.116198 180.0
[M-H]- 322.119704 183.3
[M+NH4]+ 341.160803 189.1
[M+K]+ 362.090138 176.5
[M+H-H2O]+ 306.124240 166.2
[M+HCOO]- 368.125181 202.8
[M+CH3COO]- 382.140831 214.2
[M+Na-2H]- 344.101646 180.3
[M]+ 323.12643142 176.1
[M]- 323.12752858 176.1
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.