CID 3070227

Pyrido(2,3-b)pyrazin-3(4h)-one, 4-(2-(dimethylamino)ethyl)-2-methyl-

Structural Information

Molecular Formula
C12H16N4O
SMILES
CC1=NC2=C(N=CC=C2)N(C1=O)CCN(C)C
InChI
InChI=1S/C12H16N4O/c1-9-12(17)16(8-7-15(2)3)11-10(14-9)5-4-6-13-11/h4-6H,7-8H2,1-3H3
InChIKey
RFQYNHNYBUKQBP-UHFFFAOYSA-N
Compound name
4-[2-(dimethylamino)ethyl]-2-methylpyrido[2,3-b]pyrazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

232.13242 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.13970 152.9
[M+Na]+ 255.12164 162.9
[M-H]- 231.12514 155.3
[M+NH4]+ 250.16624 168.8
[M+K]+ 271.09558 160.0
[M+H-H2O]+ 215.12968 143.9
[M+HCOO]- 277.13062 174.2
[M+CH3COO]- 291.14627 199.0
[M+Na-2H]- 253.10709 160.4
[M]+ 232.13187 156.6
[M]- 232.13297 156.6
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