CID 64157006

5-(3-fluorophenyl)pyrrolidin-3-ol hydrochloride

Structural Information

Molecular Formula
C10H12FNO
SMILES
C1C(CNC1C2=CC(=CC=C2)F)O
InChI
InChI=1S/C10H12FNO/c11-8-3-1-2-7(4-8)10-5-9(13)6-12-10/h1-4,9-10,12-13H,5-6H2
InChIKey
QOQHYYPIRCCHOK-UHFFFAOYSA-N
Compound name
5-(3-fluorophenyl)pyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

181.09029 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.097566 137.3
[M+Na]+ 204.079508 144.6
[M-H]- 180.083014 138.7
[M+NH4]+ 199.124113 156.4
[M+K]+ 220.053448 140.4
[M+H-H2O]+ 164.087550 130.1
[M+HCOO]- 226.088491 155.8
[M+CH3COO]- 240.104141 175.0
[M+Na-2H]- 202.064956 140.0
[M]+ 181.08974142 130.8
[M]- 181.09083858 130.8
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