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(4S,1'R)-(1'-Ethoxycarbonylmethyl-6'-phenylhexyl)-2,2-dimethyloxazolidine-3-carboxylic acid tert-butyl ester
SpectraBase Compound ID GbgMw7g2TEy
InChI InChI=1S/C26H41NO5/c1-7-30-23(28)18-21(17-13-9-12-16-20-14-10-8-11-15-20)22-19-31-26(5,6)27(22)24(29)32-25(2,3)4/h8,10-11,14-15,21-22H,7,9,12-13,16-19H2,1-6H3/t21-,22-/m1/s1
InChIKey ODQGLUWVCXIFIZ-FGZHOGPDSA-N
Mol Weight 447.6 g/mol
Molecular Formula C26H41NO5
Exact Mass 447.298473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wTHEe5dT6
Name (4S,1'R)-(1'-Ethoxycarbonylmethyl-6'-phenylhexyl)-2,2-dimethyloxazolidine-3-carboxylic acid tert-butyl ester
Alternate Name(s) tert-Butyl (4S)-4-[(1R)-1-(2-ethoxy-2-oxoethyl)-6-phenylhexyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H41NO5
InChI InChI=1S/C26H41NO5/c1-7-30-23(28)18-21(17-13-9-12-16-20-14-10-8-11-15-20)22-19-31-26(5,6)27(22)24(29)32-25(2,3)4/h8,10-11,14-15,21-22H,7,9,12-13,16-19H2,1-6H3/t21-,22-/m1/s1
InChIKey ODQGLUWVCXIFIZ-FGZHOGPDSA-N
Molecular Weight 447.616 g/mol
SMILES C(N1C(OC[C@@]1([C@@](CC(=O)OCC)(CCCCCc1ccccc1)[H])[H])(C)C)(OC(C)(C)C)=O
SPLASH splash10-0ue9-0639000000-8345eead8640fcfe9178
Source of Spectrum QA-47-97-6
Wiley ID 863299