CID 4629

Oxotremorine m

Structural Information

Molecular Formula
C11H19N2O
SMILES
C[N+](C)(C)CC#CCN1CCCC1=O
InChI
InChI=1S/C11H19N2O/c1-13(2,3)10-5-4-8-12-9-6-7-11(12)14/h6-10H2,1-3H3/q+1
InChIKey
CANZROMYQDHYHR-UHFFFAOYSA-N
Compound name
trimethyl-[4-(2-oxopyrrolidin-1-yl)but-2-ynyl]azanium
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

206
References

371
Patents

195.14973 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.15701 144.1
[M+Na]+ 218.13895 154.8
[M+NH4]+ 213.18355 149.1
[M+K]+ 234.11289 148.3
[M-H]- 194.14245 138.3
[M+Na-2H]- 216.12440 146.0
[M]+ 195.14918 143.3
[M]- 195.15028 143.3
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