CID 93714

57563-07-2

Structural Information

Molecular Formula
C18H20N8O
SMILES
CCN(CC)C1=CC(=C(C=C1)N=NC2=NC(=C(N2C)C#N)C#N)NC(=O)C
InChI
InChI=1S/C18H20N8O/c1-5-26(6-2)13-7-8-14(15(9-13)21-12(3)27)23-24-18-22-16(10-19)17(11-20)25(18)4/h7-9H,5-6H2,1-4H3,(H,21,27)
InChIKey
AEHRLZWWXVZUHG-UHFFFAOYSA-N
Compound name
N-[2-[(4,5-dicyano-1-methylimidazol-2-yl)diazenyl]-5-(diethylamino)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.176 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.18328 189.0
[M+Na]+ 387.16522 195.9
[M-H]- 363.16872 192.7
[M+NH4]+ 382.20982 196.0
[M+K]+ 403.13916 193.7
[M+H-H2O]+ 347.17326 169.1
[M+HCOO]- 409.17420 202.9
[M+CH3COO]- 423.18985 249.0
[M+Na-2H]- 385.15067 186.9
[M]+ 364.17545 182.7
[M]- 364.17655 182.7
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.