CID 216212

Fenamifuril

Structural Information

Molecular Formula

C₁₄H₁₇NO₅

SMILES

C1CC(OC1)COC(=O)COC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C14H17NO5/c15-14(17)11-5-1-2-6-12(11)19-9-13(16)20-8-10-4-3-7-18-10/h1-2,5-6,10H,3-4,7-9H2,(H2,15,17)

InChIKey

CNANHKGYHBTGAQ-UHFFFAOYSA-N

Compound name

oxolan-2-ylmethyl 2-(2-carbamoylphenoxy)acetate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 25
Patents: 279.1107 Da
Monoisotopic Mass: 1.1
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]+	280.117976	162.9
[M+Na]+	302.099918	167.0
[M-H]-	278.103424	169.1
[M+NH4]+	297.144523	177.9
[M+K]+	318.073858	166.9
[M+H-H2O]+	262.107960	155.5
[M+HCOO]-	324.108901	184.0
[M+CH3COO]-	338.124551	198.0
[M+Na-2H]-	300.085366	163.9
[M]+	279.11015142	163.5
[M]-	279.11124858	163.5

Literature stripe

literature stripe

Patent stripe

patents stripe