CID 15235179

3-oxa-8-azabicyclo[3.2.1]octane hydrochloride

Structural Information

Molecular Formula
C6H11NO
SMILES
C1CC2COCC1N2
InChI
InChI=1S/C6H11NO/c1-2-6-4-8-3-5(1)7-6/h5-7H,1-4H2
InChIKey
MNILDQSRDHCFJG-UHFFFAOYSA-N
Compound name
3-oxa-8-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3122
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