CID 71792

Talsaclidine

Structural Information

Molecular Formula
C10H15NO
SMILES
C#CCO[C@H]1CN2CCC1CC2
InChI
InChI=1S/C10H15NO/c1-2-7-12-10-8-11-5-3-9(10)4-6-11/h1,9-10H,3-8H2/t10-/m0/s1
InChIKey
XVFJONKUSLSKSW-JTQLQIEISA-N
Compound name
(3R)-3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

11
References

1408
Patents

165.11537 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 135.6
[M+Na]+ 188.10459 143.5
[M-H]- 164.10809 130.9
[M+NH4]+ 183.14919 157.0
[M+K]+ 204.07853 136.2
[M+H-H2O]+ 148.11263 125.4
[M+HCOO]- 210.11357 142.5
[M+CH3COO]- 224.12922 145.0
[M+Na-2H]- 186.09004 145.3
[M]+ 165.11482 131.4
[M]- 165.11592 131.4
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.