CID 343403

Nsc382827

Structural Information

Molecular Formula
C24H20O5
SMILES
C1C2C(OC1=O)OC3=C2C(=CC(=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5
InChI
InChI=1S/C24H20O5/c25-22-13-19-23-20(27-15-17-9-5-2-6-10-17)11-18(12-21(23)28-24(19)29-22)26-14-16-7-3-1-4-8-16/h1-12,19,24H,13-15H2
InChIKey
ORBNSZIFSHYNEG-UHFFFAOYSA-N
Compound name
6,8-bis(phenylmethoxy)-3a,8b-dihydro-1H-furo[2,3-b][1]benzofuran-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.13107 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.13835 189.1
[M+Na]+ 411.12029 196.6
[M-H]- 387.12379 202.1
[M+NH4]+ 406.16489 202.9
[M+K]+ 427.09423 194.2
[M+H-H2O]+ 371.12833 182.0
[M+HCOO]- 433.12927 208.6
[M+CH3COO]- 447.14492 200.4
[M+Na-2H]- 409.10574 190.6
[M]+ 388.13052 194.2
[M]- 388.13162 194.2
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.