CID 102500228

1251730-60-5

Structural Information

Molecular Formula
C19H19NO4
SMILES
CC1=CC(=C2C=C(OC2=C1)C(=O)NC3=C(C=CC(=C3)OC)OC)C
InChI
InChI=1S/C19H19NO4/c1-11-7-12(2)14-10-18(24-17(14)8-11)19(21)20-15-9-13(22-3)5-6-16(15)23-4/h5-10H,1-4H3,(H,20,21)
InChIKey
KUBNPFPUDYJCDP-UHFFFAOYSA-N
Compound name
N-(2,5-dimethoxyphenyl)-4,6-dimethyl-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

325.1314 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.13868 175.8
[M+Na]+ 348.12062 185.9
[M-H]- 324.12412 185.6
[M+NH4]+ 343.16522 191.8
[M+K]+ 364.09456 183.6
[M+H-H2O]+ 308.12866 168.4
[M+HCOO]- 370.12960 200.4
[M+CH3COO]- 384.14525 213.0
[M+Na-2H]- 346.10607 179.1
[M]+ 325.13085 183.8
[M]- 325.13195 183.8
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