CID 200701

2541-36-8

Structural Information

Molecular Formula
C17H20FNO
SMILES
CN(C)CCC(C1=CC=CC=C1)(C2=CC=C(C=C2)F)O
InChI
InChI=1S/C17H20FNO/c1-19(2)13-12-17(20,14-6-4-3-5-7-14)15-8-10-16(18)11-9-15/h3-11,20H,12-13H2,1-2H3
InChIKey
VJZPFPCSKVABCG-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-1-(4-fluorophenyl)-1-phenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.1529 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.160176 163.9
[M+Na]+ 296.142118 169.5
[M-H]- 272.145624 168.9
[M+NH4]+ 291.186723 179.6
[M+K]+ 312.116058 165.8
[M+H-H2O]+ 256.150160 155.4
[M+HCOO]- 318.151101 184.9
[M+CH3COO]- 332.166751 203.0
[M+Na-2H]- 294.127566 168.9
[M]+ 273.15235142 162.9
[M]- 273.15344858 162.9
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.