CID 140903591

1-(3-diphenylphosphorylcarbonyl-2,4,6-trimethylphenyl)ethanone

Structural Information

Molecular Formula
C24H23O3P
SMILES
CC1=CC(=C(C(=C1C(=O)C)C)C(=O)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)C
InChI
InChI=1S/C24H23O3P/c1-16-15-17(2)23(18(3)22(16)19(4)25)24(26)28(27,20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-15H,1-4H3
InChIKey
GAZABGVIGVGMQV-UHFFFAOYSA-N
Compound name
1-(3-diphenylphosphorylcarbonyl-2,4,6-trimethylphenyl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

390.1385 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.14578 194.2
[M+Na]+ 413.12772 200.7
[M-H]- 389.13122 202.9
[M+NH4]+ 408.17232 205.6
[M+K]+ 429.10166 196.2
[M+H-H2O]+ 373.13576 182.5
[M+HCOO]- 435.13670 218.7
[M+CH3COO]- 449.15235 225.2
[M+Na-2H]- 411.11317 191.0
[M]+ 390.13795 196.7
[M]- 390.13905 196.7
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