CID 68147

8-azabicyclo[3.2.1]octan-3-ol

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CC2CC(CC1N2)O
InChI
InChI=1S/C7H13NO/c9-7-3-5-1-2-6(4-7)8-5/h5-9H,1-4H2
InChIKey
YYMCYJLIYNNOMK-UHFFFAOYSA-N
Compound name
8-azabicyclo[3.2.1]octan-3-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

4
References

1557
Patents

127.09972 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 127.0
[M+Na]+ 150.088938 133.0
[M-H]- 126.092444 125.3
[M+NH4]+ 145.133543 149.9
[M+K]+ 166.062878 130.4
[M+H-H2O]+ 110.096980 122.2
[M+HCOO]- 172.097921 142.8
[M+CH3COO]- 186.113571 139.0
[M+Na-2H]- 148.074386 132.2
[M]+ 127.09917142 120.5
[M]- 127.10026858 120.5
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