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(4R,5S)-3-[(2R,3S)-7,7-DICHLORO-3-HYDROXY-2-METHYLOCTANOYL]-4-METHYL-5-PHENYL-2-OXAZOLIDINONE
SpectraBase Compound ID FP1TOPXoe1I
InChI InChI=1S/C19H25Cl2NO4/c1-12(15(23)10-7-11-19(3,20)21)17(24)22-13(2)16(26-18(22)25)14-8-5-4-6-9-14/h4-6,8-9,12-13,15-16,23H,7,10-11H2,1-3H3/t12-,13+,15+,16+/m1/s1
InChIKey ZZRUECNWEJVXCM-VRKREXBASA-N
Mol Weight 402.32 g/mol
Molecular Formula C19H25Cl2NO4
Exact Mass 401.116064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3CMqw0sTx80
Name (4R,5S)-3-[(2R,3S)-7,7-DICHLORO-3-HYDROXY-2-METHYLOCTANOYL]-4-METHYL-5-PHENYL-2-OXAZOLIDINONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H25Cl2NO4
InChI InChI=1S/C19H25Cl2NO4/c1-12(15(23)10-7-11-19(3,20)21)17(24)22-13(2)16(26-18(22)25)14-8-5-4-6-9-14/h4-6,8-9,12-13,15-16,23H,7,10-11H2,1-3H3/t12-,13+,15+,16+/m1/s1
InChIKey ZZRUECNWEJVXCM-VRKREXBASA-N
Literature Reference Author H.SONE,T.KONDO,M.KITYU,H.ISHIWATA,M.OJIKA,K.YAMADA
Literature Reference Citation J.ORG.CHEM.,60,4774(1995)
Literature Reference DOI 10.1021/jo00120a021
Molecular Weight 402.318 g/mol
Solvent CDCl3
Source File Reference UWMZ2314