CID 121604836

Tert-butyl 3-aminobicyclo[1.1.1]pentane-1-carboxylate

Structural Information

Molecular Formula
C10H17NO2
SMILES
CC(C)(C)OC(=O)C12CC(C1)(C2)N
InChI
InChI=1S/C10H17NO2/c1-8(2,3)13-7(12)9-4-10(11,5-9)6-9/h4-6,11H2,1-3H3
InChIKey
IYZGTBCLPDXZGM-UHFFFAOYSA-N
Compound name
tert-butyl 3-aminobicyclo[1.1.1]pentane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

183.12593 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.13321 161.3
[M+Na]+ 206.11515 156.9
[M+NH4]+ 201.15975 160.3
[M+K]+ 222.08909 155.1
[M-H]- 182.11865 153.5
[M+Na-2H]- 204.10060 156.5
[M]+ 183.12538 155.8
[M]- 183.12648 155.8
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

patents stripe