CID 3067529

2-benzofurancarboxamide, n,n,3,5-tetramethyl-

Structural Information

Molecular Formula
C13H15NO2
SMILES
CC1=CC2=C(C=C1)OC(=C2C)C(=O)N(C)C
InChI
InChI=1S/C13H15NO2/c1-8-5-6-11-10(7-8)9(2)12(16-11)13(15)14(3)4/h5-7H,1-4H3
InChIKey
AAJPTEWWSJQKER-UHFFFAOYSA-N
Compound name
N,N,3,5-tetramethyl-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

217.11028 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.11756 147.4
[M+Na]+ 240.09950 157.6
[M-H]- 216.10300 155.2
[M+NH4]+ 235.14410 168.7
[M+K]+ 256.07344 157.1
[M+H-H2O]+ 200.10754 141.8
[M+HCOO]- 262.10848 172.9
[M+CH3COO]- 276.12413 195.7
[M+Na-2H]- 238.08495 152.3
[M]+ 217.10973 153.5
[M]- 217.11083 153.5
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