CID 77276

3691-93-8

Structural Information

Molecular Formula

C₂₁H₁₇NO₄

SMILES

CCOC1=CC=CC=C1NC(=O)C2=C(C=C3C4=CC=CC=C4OC3=C2)O

InChI

InChI=1S/C21H17NO4/c1-2-25-19-10-6-4-8-16(19)22-21(24)15-12-20-14(11-17(15)23)13-7-3-5-9-18(13)26-20/h3-12,23H,2H2,1H3,(H,22,24)

InChIKey

XXETVWBJQXPSKM-UHFFFAOYSA-N

Compound name

N-(2-ethoxyphenyl)-2-hydroxydibenzofuran-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 347.11575 Da
Monoisotopic Mass: 5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	348.123026	179.6
[M+Na]+	370.104968	188.7
[M-H]-	346.108474	188.5
[M+NH4]+	365.149573	194.4
[M+K]+	386.078908	184.8
[M+H-H2O]+	330.113010	171.9
[M+HCOO]-	392.113951	201.7
[M+CH3COO]-	406.129601	191.4
[M+Na-2H]-	368.090416	185.1
[M]+	347.11520142	184.8
[M]-	347.11629858	184.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe