CID 269593

19270-42-9

Structural Information

Molecular Formula
C16H14ClN5O2
SMILES
CCOC(=O)NC1=NC2=NC=CN=C2C(=C1)NC3=CC=C(C=C3)Cl
InChI
InChI=1S/C16H14ClN5O2/c1-2-24-16(23)22-13-9-12(14-15(21-13)19-8-7-18-14)20-11-5-3-10(17)4-6-11/h3-9H,2H2,1H3,(H2,19,20,21,22,23)
InChIKey
HJKLJKMUSYIQOM-UHFFFAOYSA-N
Compound name
ethyl N-[8-(4-chloroanilino)pyrido[2,3-b]pyrazin-6-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

343.0836 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.09088 176.6
[M+Na]+ 366.07282 185.2
[M-H]- 342.07632 180.2
[M+NH4]+ 361.11742 187.0
[M+K]+ 382.04676 179.1
[M+H-H2O]+ 326.08086 166.2
[M+HCOO]- 388.08180 192.9
[M+CH3COO]- 402.09745 186.4
[M+Na-2H]- 364.05827 184.4
[M]+ 343.08305 179.9
[M]- 343.08415 179.9
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

patents stripe