CID 53887482

2,5-oxazolidinedione, 4-[(4-hydroxyphenyl)methyl]-, (4s)-

Structural Information

Molecular Formula

C₁₀H₉NO₄

SMILES

C1=CC(=CC=C1C[C@H]2C(=O)OC(=O)N2)O

InChI

InChI=1S/C10H9NO4/c12-7-3-1-6(2-4-7)5-8-9(13)15-10(14)11-8/h1-4,8,12H,5H2,(H,11,14)/t8-/m0/s1

InChIKey

HOEAPYNDVBABMC-QMMMGPOBSA-N

Compound name

(4S)-4-[(4-hydroxyphenyl)methyl]-1,3-oxazolidine-2,5-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 102
Patents: 207.05316 Da
Monoisotopic Mass: 1.2
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]+	208.060436	141.2
[M+Na]+	230.042378	149.7
[M-H]-	206.045884	145.1
[M+NH4]+	225.086983	157.9
[M+K]+	246.016318	147.4
[M+H-H2O]+	190.050420	135.0
[M+HCOO]-	252.051361	160.8
[M+CH3COO]-	266.067011	178.4
[M+Na-2H]-	228.027826	144.9
[M]+	207.05261142	139.8
[M]-	207.05370858	139.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe