CID 3005439

Nsc700362

Structural Information

Molecular Formula
C10H6N8O2
SMILES
C(#N)/C(=C(\NC(=O)C(=O)N/C(=C(/N)\C#N)/C#N)/C#N)/N
InChI
InChI=1S/C10H6N8O2/c11-1-5(15)7(3-13)17-9(19)10(20)18-8(4-14)6(16)2-12/h15-16H2,(H,17,19)(H,18,20)/b7-5+,8-6+
InChIKey
CZVFLHJYNNNIAJ-KQQUZDAGSA-N
Compound name
N,N'-bis[(E)-2-amino-1,2-dicyanoethenyl]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.06137 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.06865 173.1
[M+Na]+ 293.05059 175.6
[M-H]- 269.05409 175.8
[M+NH4]+ 288.09519 175.5
[M+K]+ 309.02453 176.0
[M+H-H2O]+ 253.05863 164.4
[M+HCOO]- 315.05957 173.7
[M+CH3COO]- 329.07522 249.8
[M+Na-2H]- 291.03604 168.2
[M]+ 270.06082 166.1
[M]- 270.06192 166.1
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.