CID 155487322

2408965-41-1

Structural Information

Molecular Formula
C9H13NO2
SMILES
COC(=O)C12C3C1CC(C3)C2N
InChI
InChI=1S/C9H13NO2/c1-12-8(11)9-5-2-4(7(9)10)3-6(5)9/h4-7H,2-3,10H2,1H3
InChIKey
HSEAYBBXRZDUJG-UHFFFAOYSA-N
Compound name
methyl 7-aminotricyclo[2.2.1.02,6]heptane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.09464 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.10192 130.1
[M+Na]+ 190.08386 138.2
[M+NH4]+ 185.12846 141.9
[M+K]+ 206.05780 138.7
[M-H]- 166.08736 135.3
[M+Na-2H]- 188.06931 131.3
[M]+ 167.09409 133.7
[M]- 167.09519 133.7
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.