CID 21798

Anilamate

Structural Information

Molecular Formula

C₁₅H₁₄N₂O₃

SMILES

CNC(=O)OC1=CC=CC=C1C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C15H14N2O3/c1-16-15(19)20-13-10-6-5-9-12(13)14(18)17-11-7-3-2-4-8-11/h2-10H,1H3,(H,16,19)(H,17,18)

InChIKey

BEECRKDUIIQEBI-UHFFFAOYSA-N

Compound name

[2-(phenylcarbamoyl)phenyl] N-methylcarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 39
Patents: 270.10043 Da
Monoisotopic Mass: 2.7
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]+	271.10771	162.1
[M+Na]+	293.08965	173.6
[M+NH4]+	288.13425	169.0
[M+K]+	309.06359	167.6
[M-H]-	269.09315	166.3
[M+Na-2H]-	291.07510	170.3
[M]+	270.09988	164.7
[M]-	270.10098	164.7

Literature stripe

literature stripe

Patent stripe

patents stripe