CID 3050004

4-(4-hydroxy-2-methyl-1-oxo-5-(1-piperidinyl)pentyl)morpholine monohydrochloride

Structural Information

Molecular Formula
C15H28N2O3
SMILES
CC(CC(CN1CCCCC1)O)C(=O)N2CCOCC2
InChI
InChI=1S/C15H28N2O3/c1-13(15(19)17-7-9-20-10-8-17)11-14(18)12-16-5-3-2-4-6-16/h13-14,18H,2-12H2,1H3
InChIKey
CDCCYAOZOXZINN-UHFFFAOYSA-N
Compound name
4-hydroxy-2-methyl-1-morpholin-4-yl-5-piperidin-1-ylpentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.21 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.21728 172.0
[M+Na]+ 307.19922 170.9
[M-H]- 283.20272 172.3
[M+NH4]+ 302.24382 181.6
[M+K]+ 323.17316 170.4
[M+H-H2O]+ 267.20726 162.6
[M+HCOO]- 329.20820 180.0
[M+CH3COO]- 343.22385 197.5
[M+Na-2H]- 305.18467 170.2
[M]+ 284.20945 164.2
[M]- 284.21055 164.2
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.