CID 64169

15037-70-4

Structural Information

Molecular Formula
C17H29NO2
SMILES
C1COCCN1CCC(C23CC4CC(C2)CC(C4)C3)O
InChI
InChI=1S/C17H29NO2/c19-16(1-2-18-3-5-20-6-4-18)17-10-13-7-14(11-17)9-15(8-13)12-17/h13-16,19H,1-12H2
InChIKey
KDEJVXIPSQTVHQ-UHFFFAOYSA-N
Compound name
1-(1-adamantyl)-3-morpholin-4-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.21982 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.22710 164.3
[M+Na]+ 302.20904 162.0
[M-H]- 278.21254 158.8
[M+NH4]+ 297.25364 183.0
[M+K]+ 318.18298 159.6
[M+H-H2O]+ 262.21708 155.1
[M+HCOO]- 324.21802 162.9
[M+CH3COO]- 338.23367 169.4
[M+Na-2H]- 300.19449 171.4
[M]+ 279.21927 160.0
[M]- 279.22037 160.0
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.