SpectraBase Compound ID | JTdnOVe9VjD |
---|---|
InChI | InChI=1S/C14H18O8S/c1-21-13(20)7-3-2-6(4-8(7)16)23-14-12(19)11(18)10(17)9(5-15)22-14/h2-4,9-12,14-19H,5H2,1H3/t9-,10-,11+,12-,14+/m1/s1 |
InChIKey | RRXAJGXGSZKPNP-DIACKHNESA-N |
Mol Weight | 346.35 g/mol |
Molecular Formula | C14H18O8S |
Exact Mass | 346.072239 g/mol |
SpectraBase Spectrum ID | 3tKt9KiZioi |
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Name | 4-(beta-D-glucopyranosylthio)salicylic acid, methyl ester |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C14H18O8S |
InChI | InChI=1S/C14H18O8S/c1-21-13(20)7-3-2-6(4-8(7)16)23-14-12(19)11(18)10(17)9(5-15)22-14/h2-4,9-12,14-19H,5H2,1H3/t9-,10-,11+,12-,14+/m1/s1 |
InChIKey | RRXAJGXGSZKPNP-DIACKHNESA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 27227M |
Solvent | D2O/NaOD |