CID 62938496

3-(4-aminopiperidin-1-yl)-1-methyl-1,2-dihydropyrazin-2-one dihydrochloride

Structural Information

Molecular Formula
C10H16N4O
SMILES
CN1C=CN=C(C1=O)N2CCC(CC2)N
InChI
InChI=1S/C10H16N4O/c1-13-7-4-12-9(10(13)15)14-5-2-8(11)3-6-14/h4,7-8H,2-3,5-6,11H2,1H3
InChIKey
VQGXNRUFPSOPQQ-UHFFFAOYSA-N
Compound name
3-(4-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]+ 209.139696 148.3
[M+Na]+ 231.121638 155.9
[M-H]- 207.125144 150.4
[M+NH4]+ 226.166243 162.7
[M+K]+ 247.095578 152.4
[M+H-H2O]+ 191.129680 139.1
[M+HCOO]- 253.130621 166.5
[M+CH3COO]- 267.146271 188.2
[M+Na-2H]- 229.107086 152.6
[M]+ 208.13187142 143.5
[M]- 208.13296858 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.