CID 64250

4-morpholineethanol, alpha-(3-adamantylmethoxymethyl)-, hydrochloride

Structural Information

Molecular Formula
C18H31NO3
SMILES
C1COCCN1CC(COCC23CC4CC(C2)CC(C4)C3)O
InChI
InChI=1S/C18H31NO3/c20-17(11-19-1-3-21-4-2-19)12-22-13-18-8-14-5-15(9-18)7-16(6-14)10-18/h14-17,20H,1-13H2
InChIKey
MWKPSZICRULCTP-UHFFFAOYSA-N
Compound name
1-(1-adamantylmethoxy)-3-morpholin-4-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

309.2304 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.23768 176.5
[M+Na]+ 332.21962 183.7
[M+NH4]+ 327.26422 187.8
[M+K]+ 348.19356 174.8
[M-H]- 308.22312 176.0
[M+Na-2H]- 330.20507 171.7
[M]+ 309.22985 177.3
[M]- 309.23095 177.3
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.