CID 64488

Phenyladamantylpiperidine

Structural Information

Molecular Formula
C21H29N
SMILES
C1CCN(CC1)C2(C3CC4CC(C3)CC2C4)C5=CC=CC=C5
InChI
InChI=1S/C21H29N/c1-3-7-18(8-4-1)21(22-9-5-2-6-10-22)19-12-16-11-17(14-19)15-20(21)13-16/h1,3-4,7-8,16-17,19-20H,2,5-6,9-15H2
InChIKey
KBLCCZWZKWPYJM-UHFFFAOYSA-N
Compound name
1-(2-phenyl-2-adamantyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

295.23 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.23728 174.2
[M+Na]+ 318.21922 186.1
[M+NH4]+ 313.26382 188.5
[M+K]+ 334.19316 173.6
[M-H]- 294.22272 177.4
[M+Na-2H]- 316.20467 175.0
[M]+ 295.22945 177.1
[M]- 295.23055 177.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.