CID 647402

110345-37-4

Structural Information

Molecular Formula
C20H24FNO3
SMILES
COC1=C(C=C(C=C1)C(C(CN2CCOCC2)C3=CC=CC=C3)O)F
InChI
InChI=1S/C20H24FNO3/c1-24-19-8-7-16(13-18(19)21)20(23)17(15-5-3-2-4-6-15)14-22-9-11-25-12-10-22/h2-8,13,17,20,23H,9-12,14H2,1H3
InChIKey
RDWKKDSOTUKQKO-UHFFFAOYSA-N
Compound name
1-(3-fluoro-4-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

345.174 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.18128 183.1
[M+Na]+ 368.16322 186.0
[M-H]- 344.16672 188.0
[M+NH4]+ 363.20782 191.8
[M+K]+ 384.13716 182.9
[M+H-H2O]+ 328.17126 172.0
[M+HCOO]- 390.17220 196.1
[M+CH3COO]- 404.18785 210.0
[M+Na-2H]- 366.14867 183.2
[M]+ 345.17345 179.2
[M]- 345.17455 179.2
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.