CID 120918

4-(2-((p-fluoro-alpha-phenylbenzyl)oxy)ethyl)morpholine hydrochloride

Structural Information

Molecular Formula
C19H22FNO2
SMILES
C1COCCN1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)F
InChI
InChI=1S/C19H22FNO2/c20-18-8-6-17(7-9-18)19(16-4-2-1-3-5-16)23-15-12-21-10-13-22-14-11-21/h1-9,19H,10-15H2
InChIKey
SVZZDHRLYPNIMX-UHFFFAOYSA-N
Compound name
4-[2-[(4-fluorophenyl)-phenylmethoxy]ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.16345 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.17073 175.3
[M+Na]+ 338.15267 178.5
[M-H]- 314.15617 181.1
[M+NH4]+ 333.19727 185.7
[M+K]+ 354.12661 175.3
[M+H-H2O]+ 298.16071 163.8
[M+HCOO]- 360.16165 190.9
[M+CH3COO]- 374.17730 184.1
[M+Na-2H]- 336.13812 178.0
[M]+ 315.16290 171.5
[M]- 315.16400 171.5
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.