CID 5277435

(3e)-3-(2-methoxybenzylidene)-5-(4-phenoxyphenyl)-2(3h)-furanone

Structural Information

Molecular Formula
C24H18O4
SMILES
COC1=CC=CC=C1/C=C/2\C=C(OC2=O)C3=CC=C(C=C3)OC4=CC=CC=C4
InChI
InChI=1S/C24H18O4/c1-26-22-10-6-5-7-18(22)15-19-16-23(28-24(19)25)17-11-13-21(14-12-17)27-20-8-3-2-4-9-20/h2-16H,1H3/b19-15+
InChIKey
YXMSBXKOQVAZFT-XDJHFCHBSA-N
Compound name
(3E)-3-[(2-methoxyphenyl)methylidene]-5-(4-phenoxyphenyl)furan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

370.1205 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.12778 188.3
[M+Na]+ 393.10972 196.0
[M-H]- 369.11322 202.1
[M+NH4]+ 388.15432 200.2
[M+K]+ 409.08366 191.7
[M+H-H2O]+ 353.11776 178.7
[M+HCOO]- 415.11870 211.3
[M+CH3COO]- 429.13435 199.7
[M+Na-2H]- 391.09517 189.5
[M]+ 370.11995 191.0
[M]- 370.12105 191.0
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.