CID 121553704

Methyl 6-amino-2-azabicyclo[2.2.2]octane-2-carboxylate hydrochloride

Structural Information

Molecular Formula
C9H16N2O2
SMILES
COC(=O)N1CC2CCC1C(C2)N
InChI
InChI=1S/C9H16N2O2/c1-13-9(12)11-5-6-2-3-8(11)7(10)4-6/h6-8H,2-5,10H2,1H3
InChIKey
ZNARIJZRRURANQ-UHFFFAOYSA-N
Compound name
methyl 6-amino-2-azabicyclo[2.2.2]octane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.12119 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.12847 135.9
[M+Na]+ 207.11041 144.3
[M+NH4]+ 202.15501 145.5
[M+K]+ 223.08435 139.1
[M-H]- 183.11391 133.3
[M+Na-2H]- 205.09586 132.9
[M]+ 184.12064 136.0
[M]- 184.12174 136.0
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.