CID 43102245

N-[(pyridin-3-yl)methyl]pyrrolidine-2-carboxamide dihydrochloride

Structural Information

Molecular Formula
C11H15N3O
SMILES
C1CC(NC1)C(=O)NCC2=CN=CC=C2
InChI
InChI=1S/C11H15N3O/c15-11(10-4-2-6-13-10)14-8-9-3-1-5-12-7-9/h1,3,5,7,10,13H,2,4,6,8H2,(H,14,15)
InChIKey
AFUXSLOZFGPQPN-UHFFFAOYSA-N
Compound name
N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.1215 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.128776 146.0
[M+Na]+ 228.110718 150.5
[M-H]- 204.114224 147.9
[M+NH4]+ 223.155323 162.4
[M+K]+ 244.084658 147.2
[M+H-H2O]+ 188.118760 137.4
[M+HCOO]- 250.119701 165.7
[M+CH3COO]- 264.135351 182.6
[M+Na-2H]- 226.096166 150.0
[M]+ 205.12095142 140.4
[M]- 205.12204858 140.4
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.