CID 21428730

3-(4-fluorophenoxy)azetidine hydrochloride

Structural Information

Molecular Formula
C9H10FNO
SMILES
C1C(CN1)OC2=CC=C(C=C2)F
InChI
InChI=1S/C9H10FNO/c10-7-1-3-8(4-2-7)12-9-5-11-6-9/h1-4,9,11H,5-6H2
InChIKey
ZDIPYYPSOHMOMO-UHFFFAOYSA-N
Compound name
3-(4-fluorophenoxy)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

212
Patents

167.07465 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.08193 129.6
[M+Na]+ 190.06387 136.2
[M-H]- 166.06737 132.2
[M+NH4]+ 185.10847 141.7
[M+K]+ 206.03781 136.4
[M+H-H2O]+ 150.07191 117.1
[M+HCOO]- 212.07285 148.9
[M+CH3COO]- 226.08850 178.8
[M+Na-2H]- 188.04932 135.9
[M]+ 167.07410 134.7
[M]- 167.07520 134.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe