CID 83694709

1-methyl-4-[(methylamino)methyl]piperidin-2-one dihydrochloride

Structural Information

Molecular Formula
C8H16N2O
SMILES
CNCC1CCN(C(=O)C1)C
InChI
InChI=1S/C8H16N2O/c1-9-6-7-3-4-10(2)8(11)5-7/h7,9H,3-6H2,1-2H3
InChIKey
GKNIDEZVRRCAGV-UHFFFAOYSA-N
Compound name
1-methyl-4-(methylaminomethyl)piperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

156.12627 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.13355 134.9
[M+Na]+ 179.11549 140.9
[M-H]- 155.11899 136.7
[M+NH4]+ 174.16009 154.5
[M+K]+ 195.08943 139.7
[M+H-H2O]+ 139.12353 128.5
[M+HCOO]- 201.12447 155.5
[M+CH3COO]- 215.14012 180.2
[M+Na-2H]- 177.10094 139.5
[M]+ 156.12572 131.3
[M]- 156.12682 131.3
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.