CID 154814387

4-[2-(trifluoromethyl)pyrrolidin-2-yl]pyridine

Structural Information

Molecular Formula
C10H11F3N2
SMILES
C1CC(NC1)(C2=CC=NC=C2)C(F)(F)F
InChI
InChI=1S/C10H11F3N2/c11-10(12,13)9(4-1-5-15-9)8-2-6-14-7-3-8/h2-3,6-7,15H,1,4-5H2
InChIKey
MBEHGIXWTAWSCS-UHFFFAOYSA-N
Compound name
4-[2-(trifluoromethyl)pyrrolidin-2-yl]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.08743 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.094706 143.9
[M+Na]+ 239.076648 151.4
[M-H]- 215.080154 142.5
[M+NH4]+ 234.121253 162.4
[M+K]+ 255.050588 147.3
[M+H-H2O]+ 199.084690 134.2
[M+HCOO]- 261.085631 158.7
[M+CH3COO]- 275.101281 180.9
[M+Na-2H]- 237.062096 149.0
[M]+ 216.08688142 135.0
[M]- 216.08797858 135.0
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.