CID 55299119

Rac-(1r,2s,4s)-7-azabicyclo[2.2.1]heptan-2-ol hydrochloride

Structural Information

Molecular Formula
C6H11NO
SMILES
C1C[C@H]2[C@@H](C[C@@H]1N2)O
InChI
InChI=1S/C6H11NO/c8-6-3-4-1-2-5(6)7-4/h4-8H,1-3H2/t4-,5+,6-/m1/s1
InChIKey
XBZJFFHSLIVHCZ-NGJCXOISSA-N
Compound name
(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

113.08406 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 122.1
[M+Na]+ 136.07328 130.3
[M+NH4]+ 131.11788 131.3
[M+K]+ 152.04722 129.0
[M-H]- 112.07678 121.1
[M+Na-2H]- 134.05873 123.2
[M]+ 113.08351 122.6
[M]- 113.08461 122.6
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