CID 115012054

Methyl 5-aminospiro[2.3]hexane-5-carboxylate hydrochloride

Structural Information

Molecular Formula
C8H13NO2
SMILES
COC(=O)C1(CC2(C1)CC2)N
InChI
InChI=1S/C8H13NO2/c1-11-6(10)8(9)4-7(5-8)2-3-7/h2-5,9H2,1H3
InChIKey
AKDHULFWSONCQB-UHFFFAOYSA-N
Compound name
methyl 5-aminospiro[2.3]hexane-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.101916 135.4
[M+Na]+ 178.083858 143.2
[M-H]- 154.087364 142.0
[M+NH4]+ 173.128463 149.0
[M+K]+ 194.057798 145.5
[M+H-H2O]+ 138.091900 127.6
[M+HCOO]- 200.092841 156.2
[M+CH3COO]- 214.108491 183.5
[M+Na-2H]- 176.069306 142.0
[M]+ 155.09409142 145.3
[M]- 155.09518858 145.3
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.