CID 756533

N-(4-methoxybenzyl)-3-methyl-1-benzofuran-2-carboxamide

Structural Information

Molecular Formula
C18H17NO3
SMILES
CC1=C(OC2=CC=CC=C12)C(=O)NCC3=CC=C(C=C3)OC
InChI
InChI=1S/C18H17NO3/c1-12-15-5-3-4-6-16(15)22-17(12)18(20)19-11-13-7-9-14(21-2)10-8-13/h3-10H,11H2,1-2H3,(H,19,20)
InChIKey
RRJQQNBDEPFCFR-UHFFFAOYSA-N
Compound name
N-[(4-methoxyphenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

295.12085 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.128126 167.9
[M+Na]+ 318.110068 177.0
[M-H]- 294.113574 177.2
[M+NH4]+ 313.154673 184.7
[M+K]+ 334.084008 174.1
[M+H-H2O]+ 278.118110 160.6
[M+HCOO]- 340.119051 192.9
[M+CH3COO]- 354.134701 205.3
[M+Na-2H]- 316.095516 173.1
[M]+ 295.12030142 173.4
[M]- 295.12139858 173.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.