CID 12349

628-65-9

Structural Information

Molecular Formula

C₅H₁₁NO₃

SMILES

CCOCCOC(=O)N

InChI

InChI=1S/C5H11NO3/c1-2-8-3-4-9-5(6)7/h2-4H2,1H3,(H2,6,7)

InChIKey

SUTGPOOOBVWLON-UHFFFAOYSA-N

Compound name

2-ethoxyethyl carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 163
Patents: 133.0739 Da
Monoisotopic Mass: -0.2
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]+	134.08118	126.5
[M+Na]+	156.06312	134.9
[M+NH4]+	151.10772	133.2
[M+K]+	172.03706	131.2
[M-H]-	132.06662	125.1
[M+Na-2H]-	154.04857	129.2
[M]+	133.07335	126.8
[M]-	133.07445	126.8

Literature stripe

literature stripe

Patent stripe

patents stripe