CID 16073256

Schembl2838995

Structural Information

Molecular Formula
C20H20FNO4
SMILES
CC(C)OC1=C(C=C2C(=C1)C(=C(O2)C3=CC=C(C=C3)F)C(=O)NC)OC
InChI
InChI=1S/C20H20FNO4/c1-11(2)25-17-9-14-15(10-16(17)24-4)26-19(18(14)20(23)22-3)12-5-7-13(21)8-6-12/h5-11H,1-4H3,(H,22,23)
InChIKey
UABRLJFATZUPGM-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-6-methoxy-N-methyl-5-propan-2-yloxy-1-benzofuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

357.13763 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.14491 184.0
[M+Na]+ 380.12685 193.3
[M-H]- 356.13035 192.3
[M+NH4]+ 375.17145 198.5
[M+K]+ 396.10079 191.0
[M+H-H2O]+ 340.13489 175.6
[M+HCOO]- 402.13583 206.2
[M+CH3COO]- 416.15148 219.5
[M+Na-2H]- 378.11230 185.0
[M]+ 357.13708 190.7
[M]- 357.13818 190.7
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