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dl-Manno-.alpha.-ld-galacto-undecopyranoside, methyl 2,4,6,8,10-pentadeoxy-4,6,8,10-tetramethyl-7,9-o-(1-methylethylidene)-11-o-(phenylmethyl)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

dl-Manno-.alpha.-ld-galacto-undecopyranoside, methyl 2,4,6,8,10-pentadeoxy-4,6,8,10-tetramethyl-7,9-o-(1-methylethylidene)-11-o-(phenylmethyl)-
SpectraBase Compound ID DPhlDrNlWKN
InChI InChI=1S/C26H42O5S/c1-16(14-28-15-20-11-9-8-10-12-20)23-18(3)25(31-26(5,6)30-23)19(4)24-17(2)21(27)13-22(29-24)32-7/h8-12,16-19,21-25,27H,13-15H2,1-7H3/t16?,17?,18?,19?,21-,22-,23?,24+,25?/m1/s1
InChIKey FXLWQIXZDPIHQQ-XQQDHENTSA-N
Mol Weight 466.7 g/mol
Molecular Formula C26H42O5S
Exact Mass 466.275296 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JXNPXeK6hq8
Name dl-Manno-.alpha.-ld-galacto-undecopyranoside, methyl 2,4,6,8,10-pentadeoxy-4,6,8,10-tetramethyl-7,9-o-(1-methylethylidene)-11-o-(phenylmethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.275295621 u
Formula C26H42O5S
InChI InChI=1S/C26H42O5S/c1-16(14-28-15-20-11-9-8-10-12-20)23-18(3)25(31-26(5,6)30-23)19(4)24-17(2)21(27)13-22(29-24)32-7/h8-12,16-19,21-25,27H,13-15H2,1-7H3/t16?,17?,18?,19?,21-,22-,23?,24+,25?/m1/s1
InChIKey FXLWQIXZDPIHQQ-XQQDHENTSA-N
Molecular Weight 466.677 g/mol
SMILES C1(C(C(C(COCC=2C=CC=CC2)C)OC(O1)(C)C)C)C([C@@]1(C([C@](O)(C[C@](O1)(SC)[H])[H])C)[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.871171