CID 62939235

3-(3-aminopiperidin-1-yl)-1-methyl-1,2-dihydropyrazin-2-one

Structural Information

Molecular Formula
C10H16N4O
SMILES
CN1C=CN=C(C1=O)N2CCCC(C2)N
InChI
InChI=1S/C10H16N4O/c1-13-6-4-12-9(10(13)15)14-5-2-3-8(11)7-14/h4,6,8H,2-3,5,7,11H2,1H3
InChIKey
NDSZCILCRDHABL-UHFFFAOYSA-N
Compound name
3-(3-aminopiperidin-1-yl)-1-methylpyrazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.13242 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.13970 148.3
[M+Na]+ 231.12164 155.9
[M-H]- 207.12514 150.4
[M+NH4]+ 226.16624 162.7
[M+K]+ 247.09558 152.4
[M+H-H2O]+ 191.12968 139.1
[M+HCOO]- 253.13062 166.5
[M+CH3COO]- 267.14627 188.2
[M+Na-2H]- 229.10709 152.6
[M]+ 208.13187 143.5
[M]- 208.13297 143.5
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.