CID 22297531

3beta,6beta-dihydroxynortropane

Structural Information

Molecular Formula
C7H13NO2
SMILES
C1C2CC(C(N2)CC1O)O
InChI
InChI=1S/C7H13NO2/c9-5-1-4-2-7(10)6(3-5)8-4/h4-10H,1-3H2
InChIKey
MVUIPZFMWQBRCM-UHFFFAOYSA-N
Compound name
8-azabicyclo[3.2.1]octane-3,6-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

143.09464 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 129.0
[M+Na]+ 166.08386 137.4
[M+NH4]+ 161.12846 137.3
[M+K]+ 182.05780 134.8
[M-H]- 142.08736 127.6
[M+Na-2H]- 164.06931 129.4
[M]+ 143.09409 129.3
[M]- 143.09519 129.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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