CID 528086

35601-91-3

Structural Information

Molecular Formula

C₁₀H₁₃NO₃

SMILES

CCOC(=O)NC1=CC=CC=C1OC

InChI

InChI=1S/C10H13NO3/c1-3-14-10(12)11-8-6-4-5-7-9(8)13-2/h4-7H,3H2,1-2H3,(H,11,12)

InChIKey

WTBUKRADZSYPCH-UHFFFAOYSA-N

Compound name

ethyl N-(2-methoxyphenyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 195.08954 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]+	196.096816	141.1
[M+Na]+	218.078758	148.2
[M-H]-	194.082264	145.0
[M+NH4]+	213.123363	160.4
[M+K]+	234.052698	147.5
[M+H-H2O]+	178.086800	134.8
[M+HCOO]-	240.087741	166.3
[M+CH3COO]-	254.103391	185.0
[M+Na-2H]-	216.064206	147.2
[M]+	195.08899142	143.9
[M]-	195.09008858	143.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe