| SpectraBase Compound ID | EJ4Tgd54dyp |
|---|---|
| InChI | InChI=1S/C47H72O14/c1-28-15-17-34-44(3,4)19-13-21-46(34,6)32(28)25-60-39(43(53)58-12)31(24-37(49)55-9)41(51)61-27-45(5)20-14-22-47(7)33(29(2)16-18-35(45)47)26-59-38(42(52)57-11)30(40(50)56-10)23-36(48)54-8/h30-35,38-39H,1-2,13-27H2,3-12H3/t30-,31+,32+,33+,34?,35?,38-,39+,45+,46+,47-/m0/s1 |
| InChIKey | MZJAHEKMIVYFPF-GACKWSFGSA-N |
| Mol Weight | 861.1 g/mol |
| Molecular Formula | C47H72O14 |
| Exact Mass | 860.492207 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FvuXjezsNgM |
|---|---|
| Name | CRYPTOPORIC ACID C-6',6'''-DIMETHYLESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C47H72O14 |
| InChI | InChI=1S/C47H72O14/c1-28-15-17-34-44(3,4)19-13-21-46(34,6)32(28)25-60-39(43(53)58-12)31(24-37(49)55-9)41(51)61-27-45(5)20-14-22-47(7)33(29(2)16-18-35(45)47)26-59-38(42(52)57-11)30(40(50)56-10)23-36(48)54-8/h30-35,38-39H,1-2,13-27H2,3-12H3/t30-,31+,32+,33+,34?,35?,38-,39+,45+,46+,47-/m0/s1 |
| InChIKey | MZJAHEKMIVYFPF-GACKWSFGSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |