CID 57887398

86409-29-2

Structural Information

Molecular Formula

C₁₀H₁₅NO₅

SMILES

CC(C)(C)OC(=O)CC[C@H]1C(=O)OC(=O)N1

InChI

InChI=1S/C10H15NO5/c1-10(2,3)16-7(12)5-4-6-8(13)15-9(14)11-6/h6H,4-5H2,1-3H3,(H,11,14)/t6-/m0/s1

InChIKey

HUCGXHMGDPFJQK-LURJTMIESA-N

Compound name

tert-butyl 3-[(4S)-2,5-dioxo-1,3-oxazolidin-4-yl]propanoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 229.09502 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]+	230.102296	149.0
[M+Na]+	252.084238	156.1
[M-H]-	228.087744	150.5
[M+NH4]+	247.128843	165.7
[M+K]+	268.058178	156.2
[M+H-H2O]+	212.092280	144.0
[M+HCOO]-	274.093221	166.4
[M+CH3COO]-	288.108871	185.2
[M+Na-2H]-	250.069686	151.7
[M]+	229.09447142	151.0
[M]-	229.09556858	151.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe