CID 64567242

1-(1-methylpiperidin-3-yl)piperazin-2-one dihydrochloride

Structural Information

Molecular Formula
C10H19N3O
SMILES
CN1CCCC(C1)N2CCNCC2=O
InChI
InChI=1S/C10H19N3O/c1-12-5-2-3-9(8-12)13-6-4-11-7-10(13)14/h9,11H,2-8H2,1H3
InChIKey
GGZFLIJWXWNYSR-UHFFFAOYSA-N
Compound name
1-(1-methylpiperidin-3-yl)piperazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.15282 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.160096 149.7
[M+Na]+ 220.142038 153.6
[M-H]- 196.145544 149.3
[M+NH4]+ 215.186643 163.7
[M+K]+ 236.115978 150.4
[M+H-H2O]+ 180.150080 140.6
[M+HCOO]- 242.151021 161.5
[M+CH3COO]- 256.166671 181.3
[M+Na-2H]- 218.127486 151.6
[M]+ 197.15227142 139.9
[M]- 197.15336858 139.9
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

No patent data available for this compound.