CID 206122

Brn 1153610

Structural Information

Molecular Formula

C₁₂H₁₄N₂O₅

SMILES

COC1=CC=C(C=C1)N2CC(OC2=O)COC(=O)N

InChI

InChI=1S/C12H14N2O5/c1-17-9-4-2-8(3-5-9)14-6-10(19-12(14)16)7-18-11(13)15/h2-5,10H,6-7H2,1H3,(H2,13,15)

InChIKey

XZXHWCJECQUUNV-UHFFFAOYSA-N

Compound name

[3-(4-methoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 266.09027 Da
Monoisotopic Mass: 0.8
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]+	267.097546	156.8
[M+Na]+	289.079488	163.9
[M-H]-	265.082994	162.7
[M+NH4]+	284.124093	171.8
[M+K]+	305.053428	163.6
[M+H-H2O]+	249.087530	149.2
[M+HCOO]-	311.088471	178.4
[M+CH3COO]-	325.104121	196.4
[M+Na-2H]-	287.064936	158.7
[M]+	266.08972142	158.8
[M]-	266.09081858	158.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.