CID 3056056

6-anisoyl-2-mesitylbenzofuran

Structural Information

Molecular Formula
C25H22O3
SMILES
CC1=CC(=C(C(=C1)C)C2=CC3=C(O2)C=C(C=C3)C(=O)C4=CC=C(C=C4)OC)C
InChI
InChI=1S/C25H22O3/c1-15-11-16(2)24(17(3)12-15)23-13-19-5-6-20(14-22(19)28-23)25(26)18-7-9-21(27-4)10-8-18/h5-14H,1-4H3
InChIKey
YPRCKYBLWFWPQP-UHFFFAOYSA-N
Compound name
(4-methoxyphenyl)-[2-(2,4,6-trimethylphenyl)-1-benzofuran-6-yl]methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.1569 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.16418 189.3
[M+Na]+ 393.14612 207.7
[M+NH4]+ 388.19072 198.2
[M+K]+ 409.12006 200.2
[M-H]- 369.14962 198.3
[M+Na-2H]- 391.13157 198.9
[M]+ 370.15635 195.0
[M]- 370.15745 195.0
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.