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(3S,4R,5S)-3,4-Dibenzyloxy-1-(4-methoxyphenylmethyl)-5-hydroxymethylpyrrolidin-2-one
SpectraBase Compound ID JOjRLzvsxv2
InChI InChI=1S/C27H29NO5/c1-31-23-14-12-20(13-15-23)16-28-24(17-29)25(32-18-21-8-4-2-5-9-21)26(27(28)30)33-19-22-10-6-3-7-11-22/h2-15,24-26,29H,16-19H2,1H3/t24-,25+,26-/m0/s1
InChIKey KIVAHXIJDSDRQX-NXCFDTQHSA-N
Mol Weight 447.53 g/mol
Molecular Formula C27H29NO5
Exact Mass 447.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8l7kP2zgp7R
Name (3S,4R,5S)-3,4-Dibenzyloxy-1-(4-methoxyphenylmethyl)-5-hydroxymethylpyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29NO5
InChI InChI=1S/C27H29NO5/c1-31-23-14-12-20(13-15-23)16-28-24(17-29)25(32-18-21-8-4-2-5-9-21)26(27(28)30)33-19-22-10-6-3-7-11-22/h2-15,24-26,29H,16-19H2,1H3/t24-,25+,26-/m0/s1
InChIKey KIVAHXIJDSDRQX-NXCFDTQHSA-N
Molecular Weight 447.531 g/mol
SMILES OC[C@]1([C@@](OCc2ccccc2)([C@@](C(N1Cc1ccc(cc1)OC)=O)(OCc1ccccc1)[H])[H])[H]
SPLASH splash10-00dl-6900000000-86f1dcd9964a6108a94f
Source of Spectrum F-59-3050-9
Wiley ID 1677819