CID 24274288

4-(4-fluorophenyl)oxan-4-amine hydrochloride

Structural Information

Molecular Formula
C11H14FNO
SMILES
C1COCCC1(C2=CC=C(C=C2)F)N
InChI
InChI=1S/C11H14FNO/c12-10-3-1-9(2-4-10)11(13)5-7-14-8-6-11/h1-4H,5-8,13H2
InChIKey
FWBLYJGNTBGREE-UHFFFAOYSA-N
Compound name
4-(4-fluorophenyl)oxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

195.10594 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.113216 141.7
[M+Na]+ 218.095158 147.8
[M-H]- 194.098664 147.0
[M+NH4]+ 213.139763 160.9
[M+K]+ 234.069098 146.2
[M+H-H2O]+ 178.103200 134.4
[M+HCOO]- 240.104141 161.5
[M+CH3COO]- 254.119791 183.5
[M+Na-2H]- 216.080606 148.3
[M]+ 195.10539142 135.4
[M]- 195.10648858 135.4
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