CID 40415

Adamantane, 1-(2-(1-pyrrolidinyl)ethyl)-, hydrochloride

Structural Information

Molecular Formula
C16H27N
SMILES
C1CCN(C1)CCC23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C16H27N/c1-2-5-17(4-1)6-3-16-10-13-7-14(11-16)9-15(8-13)12-16/h13-15H,1-12H2
InChIKey
AGUJZMSLAKCQEA-UHFFFAOYSA-N
Compound name
1-[2-(1-adamantyl)ethyl]pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.21436 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.22164 155.3
[M+Na]+ 256.20358 155.4
[M-H]- 232.20708 151.4
[M+NH4]+ 251.24818 180.0
[M+K]+ 272.17752 150.7
[M+H-H2O]+ 216.21162 146.9
[M+HCOO]- 278.21256 159.8
[M+CH3COO]- 292.22821 162.6
[M+Na-2H]- 254.18903 161.3
[M]+ 233.21381 151.6
[M]- 233.21491 151.6
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.