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(4S,1'R)-(1'-Ethoxycarbonylmethyl-5'-phenylpentyl)-2,2-dimethyloxazolidine-3-carboxylic acid tert-butyl ester
SpectraBase Compound ID CSsan50PLXu
InChI InChI=1S/C25H39NO5/c1-7-29-22(27)17-20(16-12-11-15-19-13-9-8-10-14-19)21-18-30-25(5,6)26(21)23(28)31-24(2,3)4/h8-10,13-14,20-21H,7,11-12,15-18H2,1-6H3/t20-,21-/m1/s1
InChIKey WNFHCZFWSUUWMX-NHCUHLMSSA-N
Mol Weight 433.6 g/mol
Molecular Formula C25H39NO5
Exact Mass 433.282823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7i4z4GKPBSO
Name (4S,1'R)-(1'-Ethoxycarbonylmethyl-5'-phenylpentyl)-2,2-dimethyloxazolidine-3-carboxylic acid tert-butyl ester
Alternate Name(s) tert-Butyl (4S)-4-[(1R)-1-(2-ethoxy-2-oxoethyl)-5-phenylpentyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H39NO5
InChI InChI=1S/C25H39NO5/c1-7-29-22(27)17-20(16-12-11-15-19-13-9-8-10-14-19)21-18-30-25(5,6)26(21)23(28)31-24(2,3)4/h8-10,13-14,20-21H,7,11-12,15-18H2,1-6H3/t20-,21-/m1/s1
InChIKey WNFHCZFWSUUWMX-NHCUHLMSSA-N
Molecular Weight 433.589 g/mol
SMILES C(N1C(OC[C@@]1([C@@](CC(=O)OCC)(CCCCc1ccccc1)[H])[H])(C)C)(OC(C)(C)C)=O
SPLASH splash10-0gc0-0249000000-654ba321c436e0c02ee8
Source of Spectrum QA-47-97-6
Wiley ID 863301