CID 132285037

2198519-29-6

Structural Information

Molecular Formula
C11H19NO2
SMILES
COC(=O)C12CCCC(C1)(CC2)CN
InChI
InChI=1S/C11H19NO2/c1-14-9(13)11-4-2-3-10(7-11,8-12)5-6-11/h2-8,12H2,1H3
InChIKey
OYNLJAHBFYSZJW-UHFFFAOYSA-N
Compound name
methyl 5-(aminomethyl)bicyclo[3.2.1]octane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.14159 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 146.6
[M+Na]+ 220.13081 153.6
[M+NH4]+ 215.17541 158.0
[M+K]+ 236.10475 146.5
[M-H]- 196.13431 147.0
[M+Na-2H]- 218.11626 150.6
[M]+ 197.14104 147.6
[M]- 197.14214 147.6
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.