CID 12709

Ethyl dimethylcarbamate

Structural Information

Molecular Formula

C₅H₁₁NO₂

SMILES

CCOC(=O)N(C)C

InChI

InChI=1S/C5H11NO2/c1-4-8-5(7)6(2)3/h4H2,1-3H3

InChIKey

SUDHEDJJFGYYPL-UHFFFAOYSA-N

Compound name

ethyl N,N-dimethylcarbamate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 3
References: 754
Patents: 117.07898 Da
Monoisotopic Mass: 0.9
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]+	118.08626	123.2
[M+Na]+	140.06820	130.4
[M-H]-	116.07170	125.3
[M+NH4]+	135.11280	146.4
[M+K]+	156.04214	132.6
[M+H-H2O]+	100.07624	118.4
[M+HCOO]-	162.07718	148.6
[M+CH3COO]-	176.09283	175.0
[M+Na-2H]-	138.05365	129.1
[M]+	117.07843	126.0
[M]-	117.07953	126.0

Literature stripe

literature stripe

Patent stripe

patents stripe