CID 93715

57564-13-3

Structural Information

Molecular Formula
C17H18N8O
SMILES
CCN(CC)C1=CC(=C(C=C1)N=NC2=NC(=C(N2)C#N)C#N)NC(=O)C
InChI
InChI=1S/C17H18N8O/c1-4-25(5-2)12-6-7-13(14(8-12)20-11(3)26)23-24-17-21-15(9-18)16(10-19)22-17/h6-8H,4-5H2,1-3H3,(H,20,26)(H,21,22)
InChIKey
AMIQZHJEWZUYNL-UHFFFAOYSA-N
Compound name
N-[2-[(4,5-dicyano-1H-imidazol-2-yl)diazenyl]-5-(diethylamino)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.16037 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.16765 203.2
[M+Na]+ 373.14959 209.3
[M+NH4]+ 368.19419 201.5
[M+K]+ 389.12353 200.1
[M-H]- 349.15309 194.1
[M+Na-2H]- 371.13504 201.1
[M]+ 350.15982 199.9
[M]- 350.16092 199.9
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.