CID 63764470

8-(2-aminoethyl)-8-azabicyclo[3.2.1]octan-3-ol dihydrochloride

Structural Information

Molecular Formula
C9H18N2O
SMILES
C1CC2CC(CC1N2CCN)O
InChI
InChI=1S/C9H18N2O/c10-3-4-11-7-1-2-8(11)6-9(12)5-7/h7-9,12H,1-6,10H2
InChIKey
IBLJPEZTIBZZFX-UHFFFAOYSA-N
Compound name
8-(2-aminoethyl)-8-azabicyclo[3.2.1]octan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.1419 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.149176 138.8
[M+Na]+ 193.131118 144.3
[M-H]- 169.134624 137.8
[M+NH4]+ 188.175723 160.3
[M+K]+ 209.105058 141.7
[M+H-H2O]+ 153.139160 133.2
[M+HCOO]- 215.140101 155.7
[M+CH3COO]- 229.155751 180.0
[M+Na-2H]- 191.116566 142.2
[M]+ 170.14135142 133.5
[M]- 170.14244858 133.5
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

No patent data available for this compound.