CID 43309290

2-methoxyethyl n-(3-aminophenyl)carbamate

Structural Information

Molecular Formula

C₁₀H₁₄N₂O₃

SMILES

COCCOC(=O)NC1=CC=CC(=C1)N

InChI

InChI=1S/C10H14N2O3/c1-14-5-6-15-10(13)12-9-4-2-3-8(11)7-9/h2-4,7H,5-6,11H2,1H3,(H,12,13)

InChIKey

ZBYDMKPFQILQOD-UHFFFAOYSA-N

Compound name

2-methoxyethyl N-(3-aminophenyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 210.10045 Da
Monoisotopic Mass: 0.7
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]+	211.107726	145.2
[M+Na]+	233.089668	151.4
[M-H]-	209.093174	148.4
[M+NH4]+	228.134273	163.2
[M+K]+	249.063608	150.3
[M+H-H2O]+	193.097710	138.3
[M+HCOO]-	255.098651	170.8
[M+CH3COO]-	269.114301	189.5
[M+Na-2H]-	231.075116	150.5
[M]+	210.09990142	146.1
[M]-	210.10099858	146.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.