John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FagdZvAqZQl

(accessed ).
(-)-Sinigrin hydrate
SpectraBase Compound ID FagdZvAqZQl
InChI InChI=1S/C10H17NO9S2.K.O/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);;/q;+1;/p-1/b11-6-;;/t5-,7-,8+,9-,10+;;/m0../s1
InChIKey GVMKNQGSSYYYME-XFKKEXHPSA-M
Mol Weight 413.4533 g/mol
Molecular Formula C10H16KNO10S2
Exact Mass 412.985272 g/mol
Parent InChIKey MBBRGTKBBNEUHM-UEIPHWSUSA-M
Enantiomer InChIKey GVMKNQGSSYYYME-YEIBXKIESA-M
Copyright Copyright © 2018-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number S3305
Copyright Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number S3305
Solvent D2O
Copyright Copyright © 2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number S3305
Solvent D2O
  • Sinigrin hydrate
  • SINIGRIN MONOHYDRATE
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