CID 268567

15224-03-0

Structural Information

Molecular Formula
C18H20N6O2
SMILES
CCOC(=O)NC1=NC2=NC=C(N=C2C(=C1)N)CN(C)C3=CC=CC=C3
InChI
InChI=1S/C18H20N6O2/c1-3-26-18(25)23-15-9-14(19)16-17(22-15)20-10-12(21-16)11-24(2)13-7-5-4-6-8-13/h4-10H,3,11H2,1-2H3,(H3,19,20,22,23,25)
InChIKey
XECDBRNIHMFIOH-UHFFFAOYSA-N
Compound name
ethyl N-[8-amino-2-[(N-methylanilino)methyl]pyrido[2,3-b]pyrazin-6-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

352.16476 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.17204 183.4
[M+Na]+ 375.15398 189.7
[M-H]- 351.15748 188.0
[M+NH4]+ 370.19858 192.5
[M+K]+ 391.12792 185.7
[M+H-H2O]+ 335.16202 171.9
[M+HCOO]- 397.16296 204.6
[M+CH3COO]- 411.17861 224.1
[M+Na-2H]- 373.13943 189.7
[M]+ 352.16421 184.8
[M]- 352.16531 184.8
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

patents stripe