CID 10130010

5176-22-7

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CN2CCC1C(C2)CO
InChI
InChI=1S/C8H15NO/c10-6-8-5-9-3-1-7(8)2-4-9/h7-8,10H,1-6H2
InChIKey
GUAWHSHTXVVCLZ-UHFFFAOYSA-N
Compound name
1-azabicyclo[2.2.2]octan-3-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

175
Patents

141.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 129.8
[M+Na]+ 164.10459 134.0
[M-H]- 140.10809 123.9
[M+NH4]+ 159.14919 153.9
[M+K]+ 180.07853 132.1
[M+H-H2O]+ 124.11263 125.3
[M+HCOO]- 186.11357 139.8
[M+CH3COO]- 200.12922 140.3
[M+Na-2H]- 162.09004 141.3
[M]+ 141.11482 128.9
[M]- 141.11592 128.9
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