CID 11971383

94830-73-6

Structural Information

Molecular Formula
C24H21ClO3
SMILES
CCOC1=CC=CC2=C1OC(=C2)C(CC3=CC=CC=C3)(C4=CC=C(C=C4)Cl)O
InChI
InChI=1S/C24H21ClO3/c1-2-27-21-10-6-9-18-15-22(28-23(18)21)24(26,16-17-7-4-3-5-8-17)19-11-13-20(25)14-12-19/h3-15,26H,2,16H2,1H3
InChIKey
GSBHFRGDXKZSBY-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-1-(7-ethoxy-1-benzofuran-2-yl)-2-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

392.11792 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.12520 195.2
[M+Na]+ 415.10714 204.4
[M-H]- 391.11064 205.6
[M+NH4]+ 410.15174 208.1
[M+K]+ 431.08108 198.3
[M+H-H2O]+ 375.11518 187.3
[M+HCOO]- 437.11612 211.2
[M+CH3COO]- 451.13177 206.1
[M+Na-2H]- 413.09259 199.6
[M]+ 392.11737 202.1
[M]- 392.11847 202.1
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

patents stripe