CID 9568182

Nsc56208

Structural Information

Molecular Formula
C24H30N4O6
SMILES
CCOC1=C(C=C(C=C1)/C=N/NC(=O)C(=O)N/N=C/C2=CC(=C(C=C2)OCC)OCC)OCC
InChI
InChI=1S/C24H30N4O6/c1-5-31-19-11-9-17(13-21(19)33-7-3)15-25-27-23(29)24(30)28-26-16-18-10-12-20(32-6-2)22(14-18)34-8-4/h9-16H,5-8H2,1-4H3,(H,27,29)(H,28,30)/b25-15+,26-16+
InChIKey
YXWCHRYZYZYLSW-RYQLWAFASA-N
Compound name
N,N'-bis[(E)-(3,4-diethoxyphenyl)methylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

470.21652 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 471.22380 213.4
[M+Na]+ 493.20574 216.2
[M-H]- 469.20924 221.9
[M+NH4]+ 488.25034 221.3
[M+K]+ 509.17968 215.2
[M+H-H2O]+ 453.21378 201.6
[M+HCOO]- 515.21472 241.0
[M+CH3COO]- 529.23037 250.1
[M+Na-2H]- 491.19119 214.1
[M]+ 470.21597 222.1
[M]- 470.21707 222.1
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.