CID 18334961

3-amino-1-methylpiperidine-2,6-dione hydrochloride

Structural Information

Molecular Formula
C6H10N2O2
SMILES
CN1C(=O)CCC(C1=O)N
InChI
InChI=1S/C6H10N2O2/c1-8-5(9)3-2-4(7)6(8)10/h4H,2-3,7H2,1H3
InChIKey
PREDVCVMQCMUDT-UHFFFAOYSA-N
Compound name
3-amino-1-methylpiperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

163
Patents

142.07423 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.081506 127.5
[M+Na]+ 165.063448 135.7
[M-H]- 141.066954 129.6
[M+NH4]+ 160.108053 147.6
[M+K]+ 181.037388 134.5
[M+H-H2O]+ 125.071490 121.8
[M+HCOO]- 187.072431 148.6
[M+CH3COO]- 201.088081 175.9
[M+Na-2H]- 163.048896 131.5
[M]+ 142.07368142 123.5
[M]- 142.07477858 123.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe