| SpectraBase Compound ID | 1X6DELKOSrW |
|---|---|
| InChI | InChI=1S/C29H38O11/c1-8-12(2)25(34)40-20-22-28(7)24(38-15(5)31)19(33)21-27(6)16(13(3)9-17(32)23(27)37-14(4)30)10-18(39-26(20)35)29(21,22)11-36-28/h9,12,16,18-24,33H,8,10-11H2,1-7H3/t12?,16?,18?,19-,20?,21?,22?,23-,24+,27+,28+,29-/m0/s1 |
| InChIKey | ZPDUWMQZPPYFCZ-WBXZMGRYSA-N |
| Mol Weight | 562.6 g/mol |
| Molecular Formula | C29H38O11 |
| Exact Mass | 562.241412 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 93GP3DkARQm |
|---|---|
| Name | SIMALIKALACTONE D 1,12-DIACETATE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C29H38O11 |
| InChI | InChI=1S/C29H38O11/c1-8-12(2)25(34)40-20-22-28(7)24(38-15(5)31)19(33)21-27(6)16(13(3)9-17(32)23(27)37-14(4)30)10-18(39-26(20)35)29(21,22)11-36-28/h9,12,16,18-24,33H,8,10-11H2,1-7H3/t12?,16?,18?,19-,20?,21?,22?,23-,24+,27+,28+,29-/m0/s1 |
| InChIKey | ZPDUWMQZPPYFCZ-WBXZMGRYSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |