SpectraBase Compound ID | 6sfIMDe8j2T |
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InChI | InChI=1S/C13H17BrO9/c1-5(15)20-8-9(21-6(2)16)11(13(18)19-4)23-12(14)10(8)22-7(3)17/h8-12H,1-4H3 |
InChIKey | GWTNLHGTLIBHHZ-UHFFFAOYSA-N |
Mol Weight | 397.17 g/mol |
Molecular Formula | C13H17BrO9 |
Exact Mass | 396.005595 g/mol |
SpectraBase Spectrum ID | DOxxJ0f4p3e |
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Name | Bromo-A-D-glucopyranosyluronic acid, methyl ester |
CAS Registry Number | 21085-72-3 |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C13H17BrO9 |
InChI | InChI=1S/C13H17BrO9/c1-5(15)20-8-9(21-6(2)16)11(13(18)19-4)23-12(14)10(8)22-7(3)17/h8-12H,1-4H3 |
InChIKey | GWTNLHGTLIBHHZ-UHFFFAOYSA-N |
Instrument Name | Bruker AM-270 |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | DMSO-D6 |