CID 136806655

769143-39-7

Structural Information

Molecular Formula
C20H21N3O3
SMILES
CCC1=CC=C(C=C1)NC(=O)C(=O)NN=CC2=CC=CC(=C2O)CC=C
InChI
InChI=1S/C20H21N3O3/c1-3-6-15-7-5-8-16(18(15)24)13-21-23-20(26)19(25)22-17-11-9-14(4-2)10-12-17/h3,5,7-13,24H,1,4,6H2,2H3,(H,22,25)(H,23,26)
InChIKey
XESPWAXQGGVAKP-UHFFFAOYSA-N
Compound name
N-(4-ethylphenyl)-N'-[(2-hydroxy-3-prop-2-enylphenyl)methylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.1583 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.165576 185.1
[M+Na]+ 374.147518 189.7
[M-H]- 350.151024 191.5
[M+NH4]+ 369.192123 197.0
[M+K]+ 390.121458 185.2
[M+H-H2O]+ 334.155560 175.8
[M+HCOO]- 396.156501 209.8
[M+CH3COO]- 410.172151 221.1
[M+Na-2H]- 372.132966 186.6
[M]+ 351.15775142 185.1
[M]- 351.15884858 185.1
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.