CID 3067530

81718-73-2

Structural Information

Molecular Formula
C13H15NO3
SMILES
CC1=C(OC2=C1C=C(C=C2)OC)C(=O)N(C)C
InChI
InChI=1S/C13H15NO3/c1-8-10-7-9(16-4)5-6-11(10)17-12(8)13(15)14(2)3/h5-7H,1-4H3
InChIKey
GYZLHRMOLXESCF-UHFFFAOYSA-N
Compound name
5-methoxy-N,N,3-trimethyl-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

233.1052 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.112476 150.5
[M+Na]+ 256.094418 160.6
[M-H]- 232.097924 158.3
[M+NH4]+ 251.139023 171.1
[M+K]+ 272.068358 160.7
[M+H-H2O]+ 216.102460 144.7
[M+HCOO]- 278.103401 176.2
[M+CH3COO]- 292.119051 197.8
[M+Na-2H]- 254.079866 155.5
[M]+ 233.10465142 158.0
[M]- 233.10574858 158.0
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