CID 10405042

Schembl2839577

Structural Information

Molecular Formula
C20H20FNO3
SMILES
CC1=CC2=C(C=C1OC(C)C)C(=C(O2)C3=CC=C(C=C3)F)C(=O)NC
InChI
InChI=1S/C20H20FNO3/c1-11(2)24-16-10-15-17(9-12(16)3)25-19(18(15)20(23)22-4)13-5-7-14(21)8-6-13/h5-11H,1-4H3,(H,22,23)
InChIKey
WFEAWHLTWLKLPP-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-N,6-dimethyl-5-propan-2-yloxy-1-benzofuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

341.14273 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.15001 181.1
[M+Na]+ 364.13195 190.7
[M-H]- 340.13545 189.4
[M+NH4]+ 359.17655 196.4
[M+K]+ 380.10589 187.6
[M+H-H2O]+ 324.13999 172.9
[M+HCOO]- 386.14093 203.1
[M+CH3COO]- 400.15658 217.3
[M+Na-2H]- 362.11740 181.9
[M]+ 341.14218 186.4
[M]- 341.14328 186.4
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