CID 389320

N-[2-(2-aminoethylamino)ethyl]phenazine-1-carboxamide; cobalt; 3-methylpentane-2,4-dione

Structural Information

Molecular Formula
C17H19N5O
SMILES
C1=CC=C2C(=C1)N=C3C=CC=C(C3=N2)C(=O)NCCNCCN
InChI
InChI=1S/C17H19N5O/c18-8-9-19-10-11-20-17(23)12-4-3-7-15-16(12)22-14-6-2-1-5-13(14)21-15/h1-7,19H,8-11,18H2,(H,20,23)
InChIKey
CIGLSGZAVFJKDW-UHFFFAOYSA-N
Compound name
N-[2-(2-aminoethylamino)ethyl]phenazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.15897 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.166246 168.8
[M+Na]+ 332.148188 175.8
[M-H]- 308.151694 171.0
[M+NH4]+ 327.192793 181.8
[M+K]+ 348.122128 170.1
[M+H-H2O]+ 292.156230 159.2
[M+HCOO]- 354.157171 191.0
[M+CH3COO]- 368.172821 178.8
[M+Na-2H]- 330.133636 178.7
[M]+ 309.15842142 169.4
[M]- 309.15951858 169.4
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.