CID 101483603

1030826-34-6

Structural Information

Molecular Formula
C21H19FO
SMILES
CCC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC=C(C=C3)CO)F
InChI
InChI=1S/C21H19FO/c1-2-15-3-7-17(8-4-15)19-11-12-20(21(22)13-19)18-9-5-16(14-23)6-10-18/h3-13,23H,2,14H2,1H3
InChIKey
HDYNUXNBVWHBHL-UHFFFAOYSA-N
Compound name
[4-[4-(4-ethylphenyl)-2-fluorophenyl]phenyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.142 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.14928 172.5
[M+Na]+ 329.13122 180.7
[M-H]- 305.13472 179.9
[M+NH4]+ 324.17582 186.8
[M+K]+ 345.10516 173.8
[M+H-H2O]+ 289.13926 162.9
[M+HCOO]- 351.14020 193.4
[M+CH3COO]- 365.15585 183.7
[M+Na-2H]- 327.11667 175.2
[M]+ 306.14145 171.4
[M]- 306.14255 171.4
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.