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Diethyl (3R,4R,5S)-2-[3,4-Dibenzyloxy-5-(hydroxy)methylpyrrolidin-2-ylidene]malonate
SpectraBase Compound ID AwqcXx7zb4s
InChI InChI=1S/C26H31NO7/c1-3-31-25(29)21(26(30)32-4-2)22-24(34-17-19-13-9-6-10-14-19)23(20(15-28)27-22)33-16-18-11-7-5-8-12-18/h5-14,20,23-24,27-28H,3-4,15-17H2,1-2H3/t20-,23+,24+/m0/s1
InChIKey PFTDLMBZRLCZOO-TUACAJSNSA-N
Mol Weight 469.53 g/mol
Molecular Formula C26H31NO7
Exact Mass 469.210052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AaFzLuICx6B
Name Diethyl (3R,4R,5S)-2-[3,4-Dibenzyloxy-5-(hydroxy)methylpyrrolidin-2-ylidene]malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31NO7
InChI InChI=1S/C26H31NO7/c1-3-31-25(29)21(26(30)32-4-2)22-24(34-17-19-13-9-6-10-14-19)23(20(15-28)27-22)33-16-18-11-7-5-8-12-18/h5-14,20,23-24,27-28H,3-4,15-17H2,1-2H3/t20-,23+,24+/m0/s1
InChIKey PFTDLMBZRLCZOO-TUACAJSNSA-N
Molecular Weight 469.534 g/mol
SMILES N1[C@@](CO)([C@]([C@@](C1=C(C(=O)OCC)C(=O)OCC)(OCc1ccccc1)[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-0006-9000000000-cf903b9e59ded5d244ab
Source of Spectrum F-59-3051-13b
Wiley ID 1712205