CID 120747

597-00-2

Structural Information

Molecular Formula
C12H24N2O
SMILES
CCN(CC)C1(CN(C(CC1=O)C)C)C
InChI
InChI=1S/C12H24N2O/c1-6-14(7-2)12(4)9-13(5)10(3)8-11(12)15/h10H,6-9H2,1-5H3
InChIKey
FGRWRPVHVIQJOX-UHFFFAOYSA-N
Compound name
5-(diethylamino)-1,2,5-trimethylpiperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.18886 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.196136 149.4
[M+Na]+ 235.178078 155.8
[M-H]- 211.181584 152.8
[M+NH4]+ 230.222683 169.9
[M+K]+ 251.152018 155.4
[M+H-H2O]+ 195.186120 143.6
[M+HCOO]- 257.187061 169.3
[M+CH3COO]- 271.202711 196.7
[M+Na-2H]- 233.163526 152.0
[M]+ 212.18831142 149.4
[M]- 212.18940858 149.4
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.