CID 72756505

Norfluoxetine alcohol

Structural Information

Molecular Formula
C16H15F3O2
SMILES
C1=CC=C(C=C1)C(CCO)OC2=CC=C(C=C2)C(F)(F)F
InChI
InChI=1S/C16H15F3O2/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15,20H,10-11H2
InChIKey
WMLVVHKCLDWGLW-UHFFFAOYSA-N
Compound name
3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.10242 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.10970 169.9
[M+Na]+ 319.09164 179.8
[M+NH4]+ 314.13624 175.3
[M+K]+ 335.06558 173.5
[M-H]- 295.09514 168.6
[M+Na-2H]- 317.07709 175.6
[M]+ 296.10187 170.8
[M]- 296.10297 170.8
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.