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(2S)-3-O-[2,5-Dihydro-2-(p-methoxybenzyl)-1-(4'-methylphenyl)sulfonyl)]-1H-pyrrol-3-yl}-1,2 : 4,5-di-O-isopropylidene-.beta.-D-fructopyranose

View entire compound with spectra: 1 MS (GC)

(2S)-3-O-[2,5-Dihydro-2-(p-methoxybenzyl)-1-(4'-methylphenyl)sulfonyl)]-1H-pyrrol-3-yl}-1,2 : 4,5-di-O-isopropylidene-.beta.-D-fructopyranose
SpectraBase Compound ID J83hgmlQU8h
InChI InChI=1S/C31H39NO9S/c1-20-7-13-23(14-8-20)42(33,34)32-16-15-25(24(32)17-21-9-11-22(35-6)12-10-21)38-28-27-26(39-30(4,5)40-27)18-36-31(28)19-37-29(2,3)41-31/h7-15,24,26-28H,16-19H2,1-6H3/t24-,26?,27?,28?,31?/m0/s1
InChIKey IWQNFKLTRLZXLC-SFUWJKANSA-N
Mol Weight 601.7 g/mol
Molecular Formula C31H39NO9S
Exact Mass 601.234553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64i61sXBIov
Name (2S)-3-O-[2,5-Dihydro-2-(p-methoxybenzyl)-1-(4'-methylphenyl)sulfonyl)]-1H-pyrrol-3-yl}-1,2 : 4,5-di-O-isopropylidene-.beta.-D-fructopyranose
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H39NO9S
InChI InChI=1S/C31H39NO9S/c1-20-7-13-23(14-8-20)42(33,34)32-16-15-25(24(32)17-21-9-11-22(35-6)12-10-21)38-28-27-26(39-30(4,5)40-27)18-36-31(28)19-37-29(2,3)41-31/h7-15,24,26-28H,16-19H2,1-6H3/t24-,26?,27?,28?,31?/m0/s1
InChIKey IWQNFKLTRLZXLC-SFUWJKANSA-N
Molecular Weight 601.711 g/mol
SMILES [C@@]1(N(S(c2ccc(cc2)C)(=O)=O)CC=C1OC1C2(OC(C)(C)OC2)OCC2C1OC(C)(C)O2)(Cc1ccc(cc1)OC)[H]
SPLASH splash10-05al-6920401000-d37d150703e20f32152f
Source of Spectrum C-88-1835-0
Wiley ID 1590295