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(S)-3-Benzyl-4-isopropyloxazolidin-2-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(S)-3-Benzyl-4-isopropyloxazolidin-2-one
SpectraBase Compound ID 1p0ZydhALU
InChI InChI=1S/C13H17NO2/c1-10(2)12-9-16-13(15)14(12)8-11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3/t12-/m1/s1
InChIKey YZNNGFFAJRVQEC-GFCCVEGCSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D8bfsEcA8ml
Name (S)-3-Benzyl-4-isopropyloxazolidin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.125928789 u
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-10(2)12-9-16-13(15)14(12)8-11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3/t12-/m1/s1
InChIKey YZNNGFFAJRVQEC-GFCCVEGCSA-N
Molecular Weight 219.284 g/mol
SMILES C=1C=CC=C(C1)CN1C(OC[C@@]1(C(C)C)[H])=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.862878