CID 112564295

3-(2-chlorophenyl)-3-fluoropyrrolidine hydrochloride

Structural Information

Molecular Formula
C10H11ClFN
SMILES
C1CNCC1(C2=CC=CC=C2Cl)F
InChI
InChI=1S/C10H11ClFN/c11-9-4-2-1-3-8(9)10(12)5-6-13-7-10/h1-4,13H,5-7H2
InChIKey
PWDPUMPNNZTKFK-UHFFFAOYSA-N
Compound name
3-(2-chlorophenyl)-3-fluoropyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

199.05641 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.06369 140.0
[M+Na]+ 222.04563 148.6
[M-H]- 198.04913 142.5
[M+NH4]+ 217.09023 161.6
[M+K]+ 238.01957 143.0
[M+H-H2O]+ 182.05367 133.3
[M+HCOO]- 244.05461 155.2
[M+CH3COO]- 258.07026 152.5
[M+Na-2H]- 220.03108 144.4
[M]+ 199.05586 135.7
[M]- 199.05696 135.7
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.