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(4S)-3-[(2R,3S)-2-methyl-3-oxidanyl-3-(1-phenylsulfanylcyclooctyl)propanoyl]-4-propan-2-yl-1,3-oxazolidin-2-one
SpectraBase Compound ID CteZwS3Yjbr
InChI InChI=1S/C24H35NO4S/c1-17(2)20-16-29-23(28)25(20)22(27)18(3)21(26)24(14-10-5-4-6-11-15-24)30-19-12-8-7-9-13-19/h7-9,12-13,17-18,20-21,26H,4-6,10-11,14-16H2,1-3H3/t18-,20-,21+/m1/s1
InChIKey CAFVRIMRCNFSJC-NRSPTQNISA-N
Mol Weight 433.6 g/mol
Molecular Formula C24H35NO4S
Exact Mass 433.22868 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fXAJQhEMFm
Name (4S)-3-[(2R,3S)-2-methyl-3-oxidanyl-3-(1-phenylsulfanylcyclooctyl)propanoyl]-4-propan-2-yl-1,3-oxazolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H35NO4S
InChI InChI=1S/C24H35NO4S/c1-17(2)20-16-29-23(28)25(20)22(27)18(3)21(26)24(14-10-5-4-6-11-15-24)30-19-12-8-7-9-13-19/h7-9,12-13,17-18,20-21,26H,4-6,10-11,14-16H2,1-3H3/t18-,20-,21+/m1/s1
InChIKey CAFVRIMRCNFSJC-NRSPTQNISA-N
Molecular Weight 433.607 g/mol
SMILES O[C@](C1(Sc2ccccc2)CCCCCCC1)([C@](C(N1C(OC[C@@]1(C(C)C)[H])=O)=O)(C)[H])[H]
SPLASH splash10-01x0-2902000000-071d7c05f6fde391cf2d
Source of Spectrum KC-0-2416-13
Synonyms (4S)-3-[(2R,3S)-3-hydroxy-2-methyl-1-oxo-3-[1-(phenylthio)cyclooctyl]propyl]-4-propan-2-yl-2-oxazolidinone (4S)-3-[(2R,3S)-3-hydroxy-2-methyl-3-(1-phenylsulfanylcyclooctyl)propanoyl]-4-isopropyl-oxazolidin-2-one (4S)-3-[(2R,3S)-3-hydroxy-2-methyl-3-(1-phenylsulfanylcyclooctyl)propanoyl]-4-propan-2-yl-1,3-oxazolidin-2-one (4S)-3-[(2R,3S)-3-hydroxy-2-methyl-3-[1-(phenylthio)cyclooctyl]propanoyl]-4-isopropyl-oxazolidin-2-one
Wiley ID 784305