CID 4521351

(r,s)-1-methyl-3-nicotinoylpyrrolidine

Structural Information

Molecular Formula
C11H14N2O
SMILES
CN1CCC(C1)C(=O)C2=CN=CC=C2
InChI
InChI=1S/C11H14N2O/c1-13-6-4-10(8-13)11(14)9-3-2-5-12-7-9/h2-3,5,7,10H,4,6,8H2,1H3
InChIKey
ARYQLVJXQFGHLA-UHFFFAOYSA-N
Compound name
(1-methylpyrrolidin-3-yl)-pyridin-3-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

190.11061 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 143.1
[M+Na]+ 213.09983 154.9
[M+NH4]+ 208.14443 151.2
[M+K]+ 229.07377 150.5
[M-H]- 189.10333 145.4
[M+Na-2H]- 211.08528 149.8
[M]+ 190.11006 145.2
[M]- 190.11116 145.2
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

patents stripe