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[3(2'S),4S]-3-(2-Methyl-1-oxooctyl)-4-(phenylmethyl)-2-oxazolidinone

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

[3(2'S),4S]-3-(2-Methyl-1-oxooctyl)-4-(phenylmethyl)-2-oxazolidinone
SpectraBase Compound ID BbGY7jlKfml
InChI InChI=1S/C19H27NO3/c1-3-4-5-7-10-15(2)18(21)20-17(14-23-19(20)22)13-16-11-8-6-9-12-16/h6,8-9,11-12,15,17H,3-5,7,10,13-14H2,1-2H3/t15-,17-/m0/s1
InChIKey BXXWQQNFXCTKNV-RDJZCZTQSA-N
Mol Weight 317.43 g/mol
Molecular Formula C19H27NO3
Exact Mass 317.199094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JrMsHZ4E2CZ
Name [3(2'S),4S]-3-(2-Methyl-1-oxooctyl)-4-(phenylmethyl)-2-oxazolidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.199093730 u
Formula C19H27NO3
InChI InChI=1S/C19H27NO3/c1-3-4-5-7-10-15(2)18(21)20-17(14-23-19(20)22)13-16-11-8-6-9-12-16/h6,8-9,11-12,15,17H,3-5,7,10,13-14H2,1-2H3/t15-,17-/m0/s1
InChIKey BXXWQQNFXCTKNV-RDJZCZTQSA-N
Molecular Weight 317.429 g/mol
SMILES C1(N([C@](CO1)(CC1=CC=CC=C1)[H])C(=O)[C@](CCCCCC)(C)[H])=O