CID 3613306

2-(2-fluorophenyl)pyrrolidine

Structural Information

Molecular Formula
C10H12FN
SMILES
C1CC(NC1)C2=CC=CC=C2F
InChI
InChI=1S/C10H12FN/c11-9-5-2-1-4-8(9)10-6-3-7-12-10/h1-2,4-5,10,12H,3,6-7H2
InChIKey
NOJCVVKIBLHAGW-UHFFFAOYSA-N
Compound name
2-(2-fluorophenyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

88
Patents

165.09538 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.102656 133.7
[M+Na]+ 188.084598 140.5
[M-H]- 164.088104 136.1
[M+NH4]+ 183.129203 153.8
[M+K]+ 204.058538 136.8
[M+H-H2O]+ 148.092640 126.1
[M+HCOO]- 210.093581 153.5
[M+CH3COO]- 224.109231 146.2
[M+Na-2H]- 186.070046 137.6
[M]+ 165.09483142 127.2
[M]- 165.09592858 127.2
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