CID 545499

1-azabicyclo[3.2.1]octan-6-ol hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CC2CN(C1)CC2O
InChI
InChI=1S/C7H13NO/c9-7-5-8-3-1-2-6(7)4-8/h6-7,9H,1-5H2
InChIKey
ROZOWQBTMUUFPZ-UHFFFAOYSA-N
Compound name
1-azabicyclo[3.2.1]octan-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

91
Patents

127.09972 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 126.4
[M+Na]+ 150.08894 132.8
[M-H]- 126.09244 126.1
[M+NH4]+ 145.13354 150.0
[M+K]+ 166.06288 131.1
[M+H-H2O]+ 110.09698 121.3
[M+HCOO]- 172.09792 143.7
[M+CH3COO]- 186.11357 168.5
[M+Na-2H]- 148.07439 132.1
[M]+ 127.09917 121.8
[M]- 127.10027 121.8
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

patents stripe