CID 64274

27866-24-6

Structural Information

Molecular Formula
C20H35NO2
SMILES
C1CCC(CC1)NCC(COCC23CC4CC(C2)CC(C4)C3)O
InChI
InChI=1S/C20H35NO2/c22-19(12-21-18-4-2-1-3-5-18)13-23-14-20-9-15-6-16(10-20)8-17(7-15)11-20/h15-19,21-22H,1-14H2
InChIKey
JVIGMYCEKLTUFH-UHFFFAOYSA-N
Compound name
1-(1-adamantylmethoxy)-3-(cyclohexylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

321.26678 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.27406 178.7
[M+Na]+ 344.25600 184.4
[M+NH4]+ 339.30060 190.5
[M+K]+ 360.22994 174.7
[M-H]- 320.25950 178.2
[M+Na-2H]- 342.24145 174.6
[M]+ 321.26623 179.2
[M]- 321.26733 179.2
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.