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]+ 274.16018 163.9
[M+Na]+ 296.14212 169.5
[M-H]- 272.14562 168.9
[M+NH4]+ 291.18672 179.6
[M+K]+ 312.11606 165.8
[M+H-H2O]+ 256.15016 155.4
[M+HCOO]- 318.15110 184.9
[M+CH3COO]- 332.16675 203.0
[M+Na-2H]- 294.12757 168.9
[M]+ 273.15235 162.9
[M]- 273.15345 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.