CID 141311

26608-58-2

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CN2CCC1(CC2)CO
InChI
InChI=1S/C8H15NO/c10-7-8-1-4-9(5-2-8)6-3-8/h10H,1-7H2
InChIKey
PGGCTNQYCZTVNL-UHFFFAOYSA-N
Compound name
1-azabicyclo[2.2.2]octan-4-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

145
Patents

141.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 129.9
[M+Na]+ 164.10459 139.7
[M+NH4]+ 159.14919 142.3
[M+K]+ 180.07853 130.9
[M-H]- 140.10809 127.7
[M+Na-2H]- 162.09004 129.8
[M]+ 141.11482 130.7
[M]- 141.11592 130.7
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