CID 5092938

Ethyl n-(3-chlorophenyl)-n-hydroxycarbamate

Structural Information

Molecular Formula

C₉H₁₀ClNO₃

SMILES

CCOC(=O)N(C1=CC(=CC=C1)Cl)O

InChI

InChI=1S/C9H10ClNO3/c1-2-14-9(12)11(13)8-5-3-4-7(10)6-8/h3-6,13H,2H2,1H3

InChIKey

BZQLWRGYQZCYNE-UHFFFAOYSA-N

Compound name

ethyl N-(3-chlorophenyl)-N-hydroxycarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 215.03493 Da
Monoisotopic Mass: 2.2
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]+	216.04221	142.4
[M+Na]+	238.02415	154.2
[M+NH4]+	233.06875	150.1
[M+K]+	253.99809	149.0
[M-H]-	214.02765	143.9
[M+Na-2H]-	236.00960	148.5
[M]+	215.03438	144.6
[M]-	215.03548	144.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe