CID 155820294

Methyl 8-aminodispiro[3.1.3^{6}.1^{4}]decane-2-carboxylate hydrochloride

Structural Information

Molecular Formula
C12H19NO2
SMILES
COC(=O)C1CC2(C1)CC3(C2)CC(C3)N
InChI
InChI=1S/C12H19NO2/c1-15-10(14)8-2-11(3-8)6-12(7-11)4-9(13)5-12/h8-9H,2-7,13H2,1H3
InChIKey
ZQUIJSMZIUIHAC-UHFFFAOYSA-N
Compound name
methyl 8-aminodispiro[3.1.36.14]decane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.14159 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.14887 142.0
[M+Na]+ 232.13081 143.9
[M-H]- 208.13431 148.0
[M+NH4]+ 227.17541 144.7
[M+K]+ 248.10475 149.7
[M+H-H2O]+ 192.13885 127.1
[M+HCOO]- 254.13979 155.4
[M+CH3COO]- 268.15544 212.6
[M+Na-2H]- 230.11626 144.5
[M]+ 209.14104 160.8
[M]- 209.14214 160.8
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

No patent data available for this compound.