CID 46080

63982-25-2

Structural Information

Molecular Formula

C₁₅H₁₆N₂O₂

SMILES

CN(C)C1=CC(=CC=C1)OC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C15H16N2O2/c1-17(2)13-9-6-10-14(11-13)19-15(18)16-12-7-4-3-5-8-12/h3-11H,1-2H3,(H,16,18)

InChIKey

YNGSTYODGGYXSA-UHFFFAOYSA-N

Compound name

[3-(dimethylamino)phenyl] N-phenylcarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 256.1212 Da
Monoisotopic Mass: 3.4
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]+	257.128476	158.5
[M+Na]+	279.110418	164.0
[M-H]-	255.113924	166.5
[M+NH4]+	274.155023	175.0
[M+K]+	295.084358	162.2
[M+H-H2O]+	239.118460	150.0
[M+HCOO]-	301.119401	184.7
[M+CH3COO]-	315.135051	202.2
[M+Na-2H]-	277.095866	164.0
[M]+	256.12065142	159.4
[M]-	256.12174858	159.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.