CID 12631

Dicarfen

Structural Information

Molecular Formula

C₁₉H₂₄N₂O₂

SMILES

CCN(CC)CCOC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C19H24N2O2/c1-3-20(4-2)15-16-23-19(22)21(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3

InChIKey

YDUHWSSRUBOPKZ-UHFFFAOYSA-N

Compound name

2-(diethylamino)ethyl N,N-diphenylcarbamate

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 33
Patents: 312.18378 Da
Monoisotopic Mass: 4.0
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]+	313.191056	177.5
[M+Na]+	335.172998	180.4
[M-H]-	311.176504	185.7
[M+NH4]+	330.217603	192.0
[M+K]+	351.146938	179.1
[M+H-H2O]+	295.181040	167.7
[M+HCOO]-	357.181981	202.8
[M+CH3COO]-	371.197631	216.4
[M+Na-2H]-	333.158446	180.8
[M]+	312.18323142	180.7
[M]-	312.18432858	180.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe