CID 3050004

Morpholine, 4-(4-hydroxy-2-methyl-1-oxo-5-(1-piperidinyl)pentyl)-, 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]+ 285.217276 172.0
[M+Na]+ 307.199218 170.9
[M-H]- 283.202724 172.3
[M+NH4]+ 302.243823 181.6
[M+K]+ 323.173158 170.4
[M+H-H2O]+ 267.207260 162.6
[M+HCOO]- 329.208201 180.0
[M+CH3COO]- 343.223851 197.5
[M+Na-2H]- 305.184666 170.2
[M]+ 284.20945142 164.2
[M]- 284.21054858 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.