CID 64436552

3-[1-(pyrrolidin-3-yl)ethyl]pyridine

Structural Information

Molecular Formula
C11H16N2
SMILES
CC(C1CCNC1)C2=CN=CC=C2
InChI
InChI=1S/C11H16N2/c1-9(11-4-6-13-8-11)10-3-2-5-12-7-10/h2-3,5,7,9,11,13H,4,6,8H2,1H3
InChIKey
IXWUKPCQNSFHOH-UHFFFAOYSA-N
Compound name
3-(1-pyrrolidin-3-ylethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.13135 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.13863 140.7
[M+Na]+ 199.12057 145.8
[M-H]- 175.12407 142.6
[M+NH4]+ 194.16517 158.7
[M+K]+ 215.09451 142.7
[M+H-H2O]+ 159.12861 132.6
[M+HCOO]- 221.12955 158.9
[M+CH3COO]- 235.14520 152.1
[M+Na-2H]- 197.10602 144.0
[M]+ 176.13080 135.2
[M]- 176.13190 135.2
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

No patent data available for this compound.