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(2S,4S)-3-Benzoyl-2-(tert-butyl)-4-cyclohexylmethyl-5-oxazolidinone
SpectraBase Compound ID 4sZ1VD1uOCS
InChI InChI=1S/C21H29NO3/c1-21(2,3)20-22(18(23)16-12-8-5-9-13-16)17(19(24)25-20)14-15-10-6-4-7-11-15/h5,8-9,12-13,15,17,20H,4,6-7,10-11,14H2,1-3H3/t17-,20-/m0/s1
InChIKey RLEGJAZWECBJGH-PXNSSMCTSA-N
Mol Weight 343.47 g/mol
Molecular Formula C21H29NO3
Exact Mass 343.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9U5D6WHkNVT
Name (2S,4S)-3-Benzoyl-2-(tert-butyl)-4-cyclohexylmethyl-5-oxazolidinone
Alternate Name(s) (2S,4.xi.)-3-Benzoyl-2-(tert-butyl)-4-cyclohexylmethyl-5-oxazolidinone (2S,4S)-3-benzoyl-2-tert-butyl-4-(cyclohexylmethyl)-1,3-oxazolidin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO3
InChI InChI=1S/C21H29NO3/c1-21(2,3)20-22(18(23)16-12-8-5-9-13-16)17(19(24)25-20)14-15-10-6-4-7-11-15/h5,8-9,12-13,15,17,20H,4,6-7,10-11,14H2,1-3H3/t17-,20-/m0/s1
InChIKey RLEGJAZWECBJGH-PXNSSMCTSA-N
Molecular Weight 343.467 g/mol
SMILES [C@]1(N([C@](C(O1)=O)(CC1CCCCC1)[H])C(=O)c1ccccc1)(C(C)(C)C)[H]
SPLASH splash10-0a4r-0970000000-270b347db5f82f8607b9
Source of Spectrum QF-9-4184-9
Wiley ID 1558822