CID 2738875

Maybridge3_006009

Structural Information

Molecular Formula

C₁₉H₁₇NO₃

SMILES

C1COC2=C1C=C(C=C2)CNC(=O)C3=CC4=CC=CC=C4OC3

InChI

InChI=1S/C19H17NO3/c21-19(16-10-14-3-1-2-4-17(14)23-12-16)20-11-13-5-6-18-15(9-13)7-8-22-18/h1-6,9-10H,7-8,11-12H2,(H,20,21)

InChIKey

AOUZDOWIKMPDLS-UHFFFAOYSA-N

Compound name

N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2H-chromene-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 0
Patents: 307.12085 Da
Monoisotopic Mass: 2.8
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]+	308.128126	169.1
[M+Na]+	330.110068	175.3
[M-H]-	306.113574	178.4
[M+NH4]+	325.154673	184.2
[M+K]+	346.084008	173.0
[M+H-H2O]+	290.118110	161.6
[M+HCOO]-	352.119051	188.1
[M+CH3COO]-	366.134701	180.5
[M+Na-2H]-	328.095516	175.0
[M]+	307.12030142	169.5
[M]-	307.12139858	169.5

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.