CID 275990

2,2,3-triphenyl-2,5-dihydrofuran

Structural Information

Molecular Formula
C22H18O
SMILES
C1C=C(C(O1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H18O/c1-4-10-18(11-5-1)21-16-17-23-22(21,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-16H,17H2
InChIKey
KMSWVYLXOSDOKN-UHFFFAOYSA-N
Compound name
4,5,5-triphenyl-2H-furan
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.13577 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.14305 171.5
[M+Na]+ 321.12499 178.5
[M-H]- 297.12849 184.7
[M+NH4]+ 316.16959 187.9
[M+K]+ 337.09893 173.6
[M+H-H2O]+ 281.13303 162.3
[M+HCOO]- 343.13397 194.4
[M+CH3COO]- 357.14962 183.5
[M+Na-2H]- 319.11044 176.6
[M]+ 298.13522 169.9
[M]- 298.13632 169.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.