CID 3356614

1-(2,4-dimethylbenzoyl)-2-(2,4,6-trimethylbenzoyl)benzene

Structural Information

Molecular Formula
C25H24O2
SMILES
CC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)C3=C(C=C(C=C3C)C)C)C
InChI
InChI=1S/C25H24O2/c1-15-10-11-20(17(3)12-15)24(26)21-8-6-7-9-22(21)25(27)23-18(4)13-16(2)14-19(23)5/h6-14H,1-5H3
InChIKey
YVAVWMUFLVSZQP-UHFFFAOYSA-N
Compound name
(2,4-dimethylphenyl)-[2-(2,4,6-trimethylbenzoyl)phenyl]methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.17764 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.18492 185.8
[M+Na]+ 379.16686 194.2
[M-H]- 355.17036 196.2
[M+NH4]+ 374.21146 198.9
[M+K]+ 395.14080 188.7
[M+H-H2O]+ 339.17490 176.6
[M+HCOO]- 401.17584 206.4
[M+CH3COO]- 415.19149 222.1
[M+Na-2H]- 377.15231 183.8
[M]+ 356.17709 188.5
[M]- 356.17819 188.5
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.