CID 307457

Ethyl n-(2-ethoxyphenyl)carbamate

Structural Information

Molecular Formula

C₁₁H₁₅NO₃

SMILES

CCOC1=CC=CC=C1NC(=O)OCC

InChI

InChI=1S/C11H15NO3/c1-3-14-10-8-6-5-7-9(10)12-11(13)15-4-2/h5-8H,3-4H2,1-2H3,(H,12,13)

InChIKey

HPMBJEHEKMHVHF-UHFFFAOYSA-N

Compound name

ethyl N-(2-ethoxyphenyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 209.1052 Da
Monoisotopic Mass: 2.8
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]+	210.11248	146.3
[M+Na]+	232.09442	157.3
[M+NH4]+	227.13902	153.6
[M+K]+	248.06836	151.6
[M-H]-	208.09792	148.0
[M+Na-2H]-	230.07987	152.2
[M]+	209.10465	148.1
[M]-	209.10575	148.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe