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(2S,3S,4S,5S)-N-[(benzyloxy)carbonyl]-5-butyl-3,4-bis[(methoxymethyl)oxy]-2-(4-pentenyl)pyrrolidine
SpectraBase Compound ID I2Kt1ejZsAp
InChI InChI=1S/C25H39NO6/c1-5-7-10-16-22-24(32-19-29-4)23(31-18-28-3)21(15-8-6-2)26(22)25(27)30-17-20-13-11-9-12-14-20/h5,9,11-14,21-24H,1,6-8,10,15-19H2,2-4H3/t21-,22-,23-,24-/m0/s1
InChIKey GCJVUTSISIZNQJ-ZJZGAYNASA-N
Mol Weight 449.6 g/mol
Molecular Formula C25H39NO6
Exact Mass 449.277738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrNszqfeI4M
Name (2S,3S,4S,5S)-N-[(benzyloxy)carbonyl]-5-butyl-3,4-bis[(methoxymethyl)oxy]-2-(4-pentenyl)pyrrolidine
CAS Registry Number 117941-16-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H39NO6
InChI InChI=1S/C25H39NO6/c1-5-7-10-16-22-24(32-19-29-4)23(31-18-28-3)21(15-8-6-2)26(22)25(27)30-17-20-13-11-9-12-14-20/h5,9,11-14,21-24H,1,6-8,10,15-19H2,2-4H3/t21-,22-,23-,24-/m0/s1
InChIKey GCJVUTSISIZNQJ-ZJZGAYNASA-N
Molecular Weight 449.588 g/mol
SMILES [C@@]1(N([C@]([C@@]([C@]1(OCOC)[H])(OCOC)[H])(CCCC)[H])C(OCc1ccccc1)=O)(CCCC=C)[H]
SPLASH splash10-0006-9002000000-c3f5d73b55bcc9d6b945
Source of Spectrum C-111-1405-44
Synonyms benzyl (2S,3S,4S,5S)-2-butyl-3,4-bis(methoxymethoxy)-5-(4-pentenyl)-1-pyrrolidinecarboxylate
Wiley ID 1387453