CID 44337211

4-ethyl-1,3-oxazolidin-2-imine

Structural Information

Molecular Formula

C₅H₁₀N₂O

SMILES

CCC1COC(=N1)N

InChI

InChI=1S/C5H10N2O/c1-2-4-3-8-5(6)7-4/h4H,2-3H2,1H3,(H2,6,7)

InChIKey

JTEWXLMHFCOPAX-UHFFFAOYSA-N

Compound name

4-ethyl-4,5-dihydro-1,3-oxazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 8
Patents: 114.079315 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]+	115.08659	121.4
[M+Na]+	137.06853	131.7
[M+NH4]+	132.11314	129.7
[M+K]+	153.04247	128.9
[M-H]-	113.07204	123.8
[M+Na-2H]-	135.05398	125.9
[M]+	114.07877	123.2
[M]-	114.07986	123.2

Literature stripe

literature stripe

Patent stripe

patents stripe