CID 13226831

(4-hydroxyphenyl)ethanediamide

Structural Information

Molecular Formula

C₈H₈N₂O₃

SMILES

C1=CC(=CC=C1NC(=O)C(=O)N)O

InChI

InChI=1S/C8H8N2O3/c9-7(12)8(13)10-5-1-3-6(11)4-2-5/h1-4,11H,(H2,9,12)(H,10,13)

InChIKey

QAOBPRHPRKZZIJ-UHFFFAOYSA-N

Compound name

N'-(4-hydroxyphenyl)oxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 180.0535 Da
Monoisotopic Mass: 0.1
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]+	181.06078	136.0
[M+Na]+	203.04272	142.6
[M-H]-	179.04622	138.3
[M+NH4]+	198.08732	154.3
[M+K]+	219.01666	141.1
[M+H-H2O]+	163.05076	129.9
[M+HCOO]-	225.05170	159.9
[M+CH3COO]-	239.06735	181.1
[M+Na-2H]-	201.02817	140.5
[M]+	180.05295	132.9
[M]-	180.05405	132.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe