CID 23228

Ethyl dimethylaminomethylcarbamate

Structural Information

Molecular Formula

C₆H₁₄N₂O₂

SMILES

CCOC(=O)NCN(C)C

InChI

InChI=1S/C6H14N2O2/c1-4-10-6(9)7-5-8(2)3/h4-5H2,1-3H3,(H,7,9)

InChIKey

KZUBAQHIKJMQJO-UHFFFAOYSA-N

Compound name

ethyl N-[(dimethylamino)methyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 146.10553 Da
Monoisotopic Mass: 0.4
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]+	147.112806	132.4
[M+Na]+	169.094748	138.2
[M-H]-	145.098254	134.2
[M+NH4]+	164.139353	153.9
[M+K]+	185.068688	140.1
[M+H-H2O]+	129.102790	126.7
[M+HCOO]-	191.103731	158.4
[M+CH3COO]-	205.119381	182.9
[M+Na-2H]-	167.080196	137.8
[M]+	146.10498142	134.6
[M]-	146.10607858	134.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe