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4-Oxazolidinecarboxylic acid, 4-benzoyl-2-(1,1-dimethylethyl)-3-formyl-, methyl ester, (2R-cis)-
SpectraBase Compound ID 4u5jWteiQ3S
InChI InChI=1S/C17H21NO5/c1-16(2,3)14-18(11-19)17(10-23-14,15(21)22-4)13(20)12-8-6-5-7-9-12/h5-9,11,14H,10H2,1-4H3/t14-,17-/m1/s1
InChIKey BCZTYVAQTZWSES-RHSMWYFYSA-N
Mol Weight 319.36 g/mol
Molecular Formula C17H21NO5
Exact Mass 319.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9u0OJ3JT3EB
Name 4-Oxazolidinecarboxylic acid, 4-benzoyl-2-(1,1-dimethylethyl)-3-formyl-, methyl ester, (2R-cis)-
Alternate Name(s) (2R,4R)-4-benzoyl-2-(tert-butyl)oxazolidine-4-carbonsaure-methylester Methyl (2R,4R)-4-benzoyl-2-tert-butyl-3-formyl-1,3-oxazolidine-4-carboxylate
CAS Registry Number 114041-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO5
InChI InChI=1S/C17H21NO5/c1-16(2,3)14-18(11-19)17(10-23-14,15(21)22-4)13(20)12-8-6-5-7-9-12/h5-9,11,14H,10H2,1-4H3/t14-,17-/m1/s1
InChIKey BCZTYVAQTZWSES-RHSMWYFYSA-N
Molecular Weight 319.357 g/mol
SMILES [C@@]1(N([C@](OC1)(C(C)(C)C)[H])C=O)(C(=O)c1ccccc1)C(=O)OC
SPLASH splash10-0a4i-3940000000-282b27fc4387fc078146
Source of Spectrum H-70-1211-11
Wiley ID 1319335