CID 83094

Ethyl (hydroxymethyl)(methoxymethyl)carbamate

Structural Information

Molecular Formula

C₆H₁₃NO₄

SMILES

CCOC(=O)N(CO)COC

InChI

InChI=1S/C6H13NO4/c1-3-11-6(9)7(4-8)5-10-2/h8H,3-5H2,1-2H3

InChIKey

YXPVEMOMGTYXHU-UHFFFAOYSA-N

Compound name

ethyl N-(hydroxymethyl)-N-(methoxymethyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 163.08446 Da
Monoisotopic Mass: -0.1
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]+	164.091736	134.0
[M+Na]+	186.073678	140.2
[M-H]-	162.077184	134.3
[M+NH4]+	181.118283	154.4
[M+K]+	202.047618	142.2
[M+H-H2O]+	146.081720	128.6
[M+HCOO]-	208.082661	158.0
[M+CH3COO]-	222.098311	179.4
[M+Na-2H]-	184.059126	138.8
[M]+	163.08391142	138.1
[M]-	163.08500858	138.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.