| SpectraBase Compound ID | IF7Ms3xUnnZ |
|---|---|
| InChI | InChI=1S/C20H29NO14S2/c22-7-12-15(25)16(26)18(28)20(34-12)36-13(21-35-37(29,30)31)6-11(9-4-2-1-3-5-9)33-19-17(27)14(24)10(23)8-32-19/h1-5,10-12,14-20,22-28H,6-8H2,(H,29,30,31)/b21-13-/t10-,11?,12-,14-,15-,16+,17+,18-,19-,20+/m0/s1 |
| InChIKey | TZJUOXNQZNCHSG-KAFFKLRESA-N |
| Mol Weight | 571.57 g/mol |
| Molecular Formula | C20H29NO14S2 |
| Exact Mass | 571.102947 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CAAxAuRPPOJ |
|---|---|
| Name | 2-(A-L-Arabinosyloxy)-2-phenylethyl-glucosinolate |
| CAS Registry Number | 80754-95-6 |
| Comments | potassium salt |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C20H29NO14S2 |
| InChI | InChI=1S/C20H29NO14S2/c22-7-12-15(25)16(26)18(28)20(34-12)36-13(21-35-37(29,30)31)6-11(9-4-2-1-3-5-9)33-19-17(27)14(24)10(23)8-32-19/h1-5,10-12,14-20,22-28H,6-8H2,(H,29,30,31)/b21-13-/t10-,11?,12-,14-,15-,16+,17+,18-,19-,20+/m0/s1 |
| InChIKey | TZJUOXNQZNCHSG-KAFFKLRESA-N |
| Literature Reference | O. Olsen, K. Rasmussen, Phytochem. 20, 1857 (1981). |
| NMR Standard | Dioxane |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |