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

19
Patents

195.10594 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.11322 141.7
[M+Na]+ 218.09516 147.8
[M-H]- 194.09866 147.0
[M+NH4]+ 213.13976 160.9
[M+K]+ 234.06910 146.2
[M+H-H2O]+ 178.10320 134.4
[M+HCOO]- 240.10414 161.5
[M+CH3COO]- 254.11979 183.5
[M+Na-2H]- 216.08061 148.3
[M]+ 195.10539 135.4
[M]- 195.10649 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