CID 61238622

Tert-butyl 3-(ethylamino)-8-azabicyclo[3.2.1]octane-8-carboxylate

Structural Information

Molecular Formula
C14H26N2O2
SMILES
CCNC1CC2CCC(C1)N2C(=O)OC(C)(C)C
InChI
InChI=1S/C14H26N2O2/c1-5-15-10-8-11-6-7-12(9-10)16(11)13(17)18-14(2,3)4/h10-12,15H,5-9H2,1-4H3
InChIKey
NPXKLAYCTDTUCO-UHFFFAOYSA-N
Compound name
tert-butyl 3-(ethylamino)-8-azabicyclo[3.2.1]octane-8-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.19943 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.20671 161.6
[M+Na]+ 277.18865 168.3
[M+NH4]+ 272.23325 168.7
[M+K]+ 293.16259 165.6
[M-H]- 253.19215 160.7
[M+Na-2H]- 275.17410 161.4
[M]+ 254.19888 161.9
[M]- 254.19998 161.9
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.