CID 126821371

Rac-methyl (1r,3r,5r)-3-aminobicyclo[3.1.0]hexane-1-carboxylate hydrochloride

Structural Information

Molecular Formula
C8H13NO2
SMILES
COC(=O)C12CC1CC(C2)N
InChI
InChI=1S/C8H13NO2/c1-11-7(10)8-3-5(8)2-6(9)4-8/h5-6H,2-4,9H2,1H3
InChIKey
KNJVQXHJDWIZBM-UHFFFAOYSA-N
Compound name
methyl 3-aminobicyclo[3.1.0]hexane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 134.3
[M+Na]+ 178.08386 144.2
[M+NH4]+ 173.12846 144.6
[M+K]+ 194.05780 141.0
[M-H]- 154.08736 142.1
[M+Na-2H]- 176.06931 140.8
[M]+ 155.09409 138.9
[M]- 155.09519 138.9
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.