CID 71757211

[1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol

Structural Information

Molecular Formula
C11H14FNO
SMILES
CC1(CN(C1)C2=CC=C(C=C2)F)CO
InChI
InChI=1S/C11H14FNO/c1-11(8-14)6-13(7-11)10-4-2-9(12)3-5-10/h2-5,14H,6-8H2,1H3
InChIKey
DMHBZKHOJFIBCO-UHFFFAOYSA-N
Compound name
[1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.10594 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.113216 141.1
[M+Na]+ 218.095158 148.6
[M-H]- 194.098664 144.2
[M+NH4]+ 213.139763 154.4
[M+K]+ 234.069098 148.4
[M+H-H2O]+ 178.103200 129.5
[M+HCOO]- 240.104141 159.8
[M+CH3COO]- 254.119791 185.3
[M+Na-2H]- 216.080606 146.5
[M]+ 195.10539142 147.6
[M]- 195.10648858 147.6
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.