| SpectraBase Compound ID | 7crWGVmWAAj |
|---|---|
| InChI | InChI=1S/C31H42O17/c1-3-16-17(18(28(41)42-2)12-45-29(16)48-31-27(40)24(37)22(35)19(11-32)46-31)10-21(34)44-13-20-23(36)25(38)26(39)30(47-20)43-9-8-14-4-6-15(33)7-5-14/h3-7,12,17,19-20,22-27,29-33,35-40H,8-11,13H2,1-2H3/b16-3+/t17?,19-,20-,22-,23+,24+,25+,26-,27-,29?,30+,31+/m1/s1 |
| InChIKey | STKUCSFEBXPTAY-KDFXELKYSA-N |
| Mol Weight | 686.7 g/mol |
| Molecular Formula | C31H42O17 |
| Exact Mass | 686.2422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LvCFANkrc3B |
|---|---|
| Name | Nuezhenide |
| CAS Registry Number | 39011-92-2 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H42O17 |
| InChI | InChI=1S/C31H42O17/c1-3-16-17(18(28(41)42-2)12-45-29(16)48-31-27(40)24(37)22(35)19(11-32)46-31)10-21(34)44-13-20-23(36)25(38)26(39)30(47-20)43-9-8-14-4-6-15(33)7-5-14/h3-7,12,17,19-20,22-27,29-33,35-40H,8-11,13H2,1-2H3/b16-3+/t17?,19-,20-,22-,23+,24+,25+,26-,27-,29?,30+,31+/m1/s1 |
| InChIKey | STKUCSFEBXPTAY-KDFXELKYSA-N |
| Instrument Name | Varian XL-100 |
| Literature Reference | R.T. Calonde, C. Wong, A.I.Tsai, J. Am. Chem. Soc. 98, 3007 (1976). |
| NMR Standard | Dioxane |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |