CID 10357867

Schembl2838925

Structural Information

Molecular Formula
C20H21NO2
SMILES
CC(C)(C)C1=CC2=C(C=C1)OC(=C2C(=O)NC)C3=CC=CC=C3
InChI
InChI=1S/C20H21NO2/c1-20(2,3)14-10-11-16-15(12-14)17(19(22)21-4)18(23-16)13-8-6-5-7-9-13/h5-12H,1-4H3,(H,21,22)
InChIKey
XZEDJIYOODWKJY-UHFFFAOYSA-N
Compound name
5-tert-butyl-N-methyl-2-phenyl-1-benzofuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

307.15723 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.164506 174.4
[M+Na]+ 330.146448 183.2
[M-H]- 306.149954 183.6
[M+NH4]+ 325.191053 191.0
[M+K]+ 346.120388 179.8
[M+H-H2O]+ 290.154490 167.6
[M+HCOO]- 352.155431 196.9
[M+CH3COO]- 366.171081 208.9
[M+Na-2H]- 328.131896 179.3
[M]+ 307.15668142 178.6
[M]- 307.15777858 178.6
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