CID 137943492

2287236-72-8

Structural Information

Molecular Formula
C10H17NO2
SMILES
CCOC(=O)[C@@H]1C[C@H]2C[C@@H]1C[C@H]2N
InChI
InChI=1S/C10H17NO2/c1-2-13-10(12)8-4-7-3-6(8)5-9(7)11/h6-9H,2-5,11H2,1H3/t6-,7-,8-,9-/m1/s1
InChIKey
YDONVUZMUFVWKV-FNCVBFRFSA-N
Compound name
ethyl (1R,2R,4R,5R)-5-aminobicyclo[2.2.1]heptane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.12593 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.13321 141.1
[M+Na]+ 206.11515 147.8
[M+NH4]+ 201.15975 149.5
[M+K]+ 222.08909 146.8
[M-H]- 182.11865 141.0
[M+Na-2H]- 204.10060 141.0
[M]+ 183.12538 141.5
[M]- 183.12648 141.5
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.