CID 16674

Ethyl n,n-dibutylcarbamate

Structural Information

Molecular Formula

C₁₁H₂₃NO₂

SMILES

CCCCN(CCCC)C(=O)OCC

InChI

InChI=1S/C11H23NO2/c1-4-7-9-12(10-8-5-2)11(13)14-6-3/h4-10H2,1-3H3

InChIKey

DSICTTBMRSZYJL-UHFFFAOYSA-N

Compound name

ethyl N,N-dibutylcarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 143
Patents: 201.17288 Da
Monoisotopic Mass: 3.0
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]+	202.18016	150.0
[M+Na]+	224.16210	158.3
[M+NH4]+	219.20670	156.8
[M+K]+	240.13604	152.8
[M-H]-	200.16560	149.5
[M+Na-2H]-	222.14755	152.4
[M]+	201.17233	150.7
[M]-	201.17343	150.7

Literature stripe

literature stripe

Patent stripe

patents stripe