SpectraBase Compound ID | Cp8JNSQNdiI |
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InChI | InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10?,11-,12-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1 |
InChIKey | XUCIJNAGGSZNQT-SWRVSKMJSA-N |
Mol Weight | 457.43 g/mol |
Molecular Formula | C20H27NO11 |
Exact Mass | 457.158411 g/mol |
SpectraBase Spectrum ID | 5ilqZoKTSuV |
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Name | D-Amygdalin |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | A83202 |
CAS Registry Number | 29883-15-6 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C20H27NO11 |
InChI | InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10?,11-,12-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1 |
InChIKey | XUCIJNAGGSZNQT-SWRVSKMJSA-N |
Observed nucleus | 1H |
Solvent | DMSO-d6 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Synonyms | D-Mandelonitrile beta-gentiobioside D-Mandelonitrile 6-O-beta-D-glucosido-beta-D-glucoside D-Mandelonitrile-beta-gentiobioside Amygdalin Laetrile |
Wiley ID | SIAL_1HNMR_010682 |