CID 580038

Exo-8-methyl-8-azabicyclo(3.2.1)oct-3-yl-1-pyrrolidinepropanoate dihydrochloride hydrate

Structural Information

Molecular Formula
C15H26N2O2
SMILES
CN1C2CCC1CC(C2)OC(=O)CCN3CCCC3
InChI
InChI=1S/C15H26N2O2/c1-16-12-4-5-13(16)11-14(10-12)19-15(18)6-9-17-7-2-3-8-17/h12-14H,2-11H2,1H3
InChIKey
BWPRWNIQEYRCRX-UHFFFAOYSA-N
Compound name
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-pyrrolidin-1-ylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

266.19943 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.20671 166.4
[M+Na]+ 289.18865 173.4
[M+NH4]+ 284.23325 174.1
[M+K]+ 305.16259 171.4
[M-H]- 265.19215 166.6
[M+Na-2H]- 287.17410 166.2
[M]+ 266.19888 167.0
[M]- 266.19998 167.0
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.