CID 330826

N,n'-difurfuryloxamide

Structural Information

Molecular Formula

C₁₂H₁₂N₂O₄

SMILES

C1=COC(=C1)CNC(=O)C(=O)NCC2=CC=CO2

InChI

InChI=1S/C12H12N2O4/c15-11(13-7-9-3-1-5-17-9)12(16)14-8-10-4-2-6-18-10/h1-6H,7-8H2,(H,13,15)(H,14,16)

InChIKey

XRURWFXKCKASSN-UHFFFAOYSA-N

Compound name

N,N'-bis(furan-2-ylmethyl)oxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 62
Patents: 248.07971 Da
Monoisotopic Mass: 0.4
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]+	249.086986	155.3
[M+Na]+	271.068928	161.5
[M-H]-	247.072434	163.8
[M+NH4]+	266.113533	172.2
[M+K]+	287.042868	162.2
[M+H-H2O]+	231.076970	148.6
[M+HCOO]-	293.077911	182.5
[M+CH3COO]-	307.093561	192.5
[M+Na-2H]-	269.054376	160.5
[M]+	248.07916142	159.1
[M]-	248.08025858	159.1

Literature stripe

literature stripe

Patent stripe

patents stripe