CID 145917

Ethyl 2-carbamoyloxybenzoate

Structural Information

Molecular Formula

C₁₀H₁₁NO₄

SMILES

CCOC(=O)C1=CC=CC=C1OC(=O)N

InChI

InChI=1S/C10H11NO4/c1-2-14-9(12)7-5-3-4-6-8(7)15-10(11)13/h3-6H,2H2,1H3,(H2,11,13)

InChIKey

JFMIIMPCFQKAAD-UHFFFAOYSA-N

Compound name

ethyl 2-carbamoyloxybenzoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1
Patents: 209.0688 Da
Monoisotopic Mass: 1.0
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]+	210.07608	144.2
[M+Na]+	232.05802	154.3
[M+NH4]+	227.10262	150.5
[M+K]+	248.03196	150.3
[M-H]-	208.06152	144.7
[M+Na-2H]-	230.04347	148.9
[M]+	209.06825	145.4
[M]-	209.06935	145.4

Literature stripe

literature stripe

Patent stripe

patents stripe