CID 118372758

Dtxsid201019620

Structural Information

Molecular Formula
C19H20F2O3
SMILES
CCCCCOC1=C(C2=C(C=C1)C3=C(O2)C(=C(C=C3)OCC)F)F
InChI
InChI=1S/C19H20F2O3/c1-3-5-6-11-23-15-10-8-13-12-7-9-14(22-4-2)16(20)18(12)24-19(13)17(15)21/h7-10H,3-6,11H2,1-2H3
InChIKey
FZDRZJNTSNLYCB-UHFFFAOYSA-N
Compound name
3-ethoxy-4,6-difluoro-7-pentoxydibenzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

334.13806 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.14534 177.1
[M+Na]+ 357.12728 188.5
[M-H]- 333.13078 181.4
[M+NH4]+ 352.17188 194.5
[M+K]+ 373.10122 184.4
[M+H-H2O]+ 317.13532 168.8
[M+HCOO]- 379.13626 197.5
[M+CH3COO]- 393.15191 213.3
[M+Na-2H]- 355.11273 180.3
[M]+ 334.13751 184.9
[M]- 334.13861 184.9
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