CID 12069231

8-oxa-3-azabicyclo[3.2.1]octane

Structural Information

Molecular Formula
C6H11NO
SMILES
C1CC2CNCC1O2
InChI
InChI=1S/C6H11NO/c1-2-6-4-7-3-5(1)8-6/h5-7H,1-4H2
InChIKey
POOPWPIOIMBTOH-UHFFFAOYSA-N
Compound name
8-oxa-3-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

4694
Patents

113.08406 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 121.7
[M+Na]+ 136.07328 131.7
[M+NH4]+ 131.11788 131.5
[M+K]+ 152.04722 128.0
[M-H]- 112.07678 123.3
[M+Na-2H]- 134.05873 124.1
[M]+ 113.08351 123.3
[M]- 113.08461 123.3
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

patents stripe