CID 132314107

2138217-56-6

Structural Information

Molecular Formula
C8H13NO2
SMILES
COC(=O)[C@@H]1C[C@@H]([C@@H]2[C@H]1C2)N
InChI
InChI=1S/C8H13NO2/c1-11-8(10)6-3-7(9)5-2-4(5)6/h4-7H,2-3,9H2,1H3/t4-,5+,6-,7+/m1/s1
InChIKey
HVBLUBWAWWNPLU-UCROKIRRSA-N
Compound name
methyl (1R,2R,4S,5S)-4-aminobicyclo[3.1.0]hexane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 131.9
[M+Na]+ 178.08386 141.9
[M+NH4]+ 173.12846 140.8
[M+K]+ 194.05780 140.7
[M-H]- 154.08736 139.6
[M+Na-2H]- 176.06931 136.8
[M]+ 155.09409 136.2
[M]- 155.09519 136.2
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.