CID 3065769

2-(methylamino)-alpha-phenyltricyclo(3.3.1.1(sup 3,7))decane-2-ethanol hydrochloride

Structural Information

Molecular Formula
C19H27NO
SMILES
CNC1(C2CC3CC(C2)CC1C3)CC(C4=CC=CC=C4)O
InChI
InChI=1S/C19H27NO/c1-20-19(12-18(21)15-5-3-2-4-6-15)16-8-13-7-14(10-16)11-17(19)9-13/h2-6,13-14,16-18,20-21H,7-12H2,1H3
InChIKey
FMOIXMSAUFDYFD-UHFFFAOYSA-N
Compound name
2-[2-(methylamino)-2-adamantyl]-1-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.20926 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.21654 167.5
[M+Na]+ 308.19848 177.2
[M+NH4]+ 303.24308 180.4
[M+K]+ 324.17242 166.6
[M-H]- 284.20198 168.4
[M+Na-2H]- 306.18393 166.6
[M]+ 285.20871 169.2
[M]- 285.20981 169.2
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.