CID 63587925

3-[(3-fluorophenyl)methyl]pyrrolidin-3-ol

Structural Information

Molecular Formula
C11H14FNO
SMILES
C1CNCC1(CC2=CC(=CC=C2)F)O
InChI
InChI=1S/C11H14FNO/c12-10-3-1-2-9(6-10)7-11(14)4-5-13-8-11/h1-3,6,13-14H,4-5,7-8H2
InChIKey
NYDFCAJRPUFZDC-UHFFFAOYSA-N
Compound name
3-[(3-fluorophenyl)methyl]pyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.10594 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.11322 142.0
[M+Na]+ 218.09516 148.9
[M-H]- 194.09866 143.3
[M+NH4]+ 213.13976 162.2
[M+K]+ 234.06910 144.7
[M+H-H2O]+ 178.10320 135.0
[M+HCOO]- 240.10414 160.2
[M+CH3COO]- 254.11979 176.4
[M+Na-2H]- 216.08061 146.0
[M]+ 195.10539 135.8
[M]- 195.10649 135.8
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

No patent data available for this compound.