| SpectraBase Compound ID | LdyhHtp5hkv |
|---|---|
| InChI | InChI=1S/C26H32O10/c1-11-7-18(30)24(35-15(5)29)25(6)16(11)8-19-26(10-33-13(3)27)17(9-20(31)36-19)12(2)22(34-14(4)28)21(32)23(25)26/h7,12,16-17,19,22-24H,8-10H2,1-6H3/t12-,16+,17+,19-,22-,23-,24-,25+,26-/m1/s1 |
| InChIKey | ZOURDFBRMWJVKJ-FIZYYRHRSA-N |
| Mol Weight | 504.5 g/mol |
| Molecular Formula | C26H32O10 |
| Exact Mass | 504.199547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3fONQfO1rtq |
|---|---|
| Name | CHAPARRINONE-TRIACETATE |
| CAS Registry Number | 990-33-0 |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H32O10 |
| InChI | InChI=1S/C26H32O10/c1-11-7-18(30)24(35-15(5)29)25(6)16(11)8-19-26(10-33-13(3)27)17(9-20(31)36-19)12(2)22(34-14(4)28)21(32)23(25)26/h7,12,16-17,19,22-24H,8-10H2,1-6H3/t12-,16+,17+,19-,22-,23-,24-,25+,26-/m1/s1 |
| InChIKey | ZOURDFBRMWJVKJ-FIZYYRHRSA-N |
| Literature Reference Author | J.POLONSKY,Z.BASKEVITCH,H.E.GOTTLIEB,E.W.HAGAMAN,E.WENKERT |
| Literature Reference Citation | J.ORG.CHEM.,40,2499(1975) |
| Literature Reference DOI | 10.1021/jo00905a017 |
| Molecular Weight | 504.534 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS12429 |