CID 55291159

63820-04-2

Structural Information

Molecular Formula

C₅H₆N₂O₃

SMILES

COC(=O)C1=C(OC=N1)N

InChI

InChI=1S/C5H6N2O3/c1-9-5(8)3-4(6)10-2-7-3/h2H,6H2,1H3

InChIKey

CBYSDGQDEISDQJ-UHFFFAOYSA-N

Compound name

methyl 5-amino-1,3-oxazole-4-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 142.03784 Da
Monoisotopic Mass: 0.7
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]+	143.04512	125.9
[M+Na]+	165.02706	135.8
[M+NH4]+	160.07166	132.7
[M+K]+	181.00100	134.7
[M-H]-	141.03056	127.0
[M+Na-2H]-	163.01251	129.9
[M]+	142.03729	127.2
[M]-	142.03839	127.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe