| SpectraBase Compound ID | HQE6912n3m |
|---|---|
| InChI | InChI=1S/C33H35ClO5/c1-32(2)25-14-15-33(32,3)30-24(25)18-28(38-30)39-31(35)23-16-26(34)29(37-20-22-12-8-5-9-13-22)27(17-23)36-19-21-10-6-4-7-11-21/h4-13,16-17,24-25,28,30H,14-15,18-20H2,1-3H3/t24-,25-,28+,30-,33+/m1/s1 |
| InChIKey | ZZUANEGIVWVWJI-KVXBKHSYSA-N |
| Mol Weight | 547.1 g/mol |
| Molecular Formula | C33H35ClO5 |
| Exact Mass | 546.217302 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DeeLzBFtl1W |
|---|---|
| Name | ZZUANEGIVWVWJI-KVXBKHSYSA-N |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H35ClO5 |
| InChI | InChI=1S/C33H35ClO5/c1-32(2)25-14-15-33(32,3)30-24(25)18-28(38-30)39-31(35)23-16-26(34)29(37-20-22-12-8-5-9-13-22)27(17-23)36-19-21-10-6-4-7-11-21/h4-13,16-17,24-25,28,30H,14-15,18-20H2,1-3H3/t24-,25-,28+,30-,33+/m1/s1 |
| InChIKey | ZZUANEGIVWVWJI-KVXBKHSYSA-N |
| Literature Reference Author | M.KNOLLMUELLER,P.GAERTNER,J.PERNERSTORFER,P.POJARLIEV,H.B.ST EGMANN |
| Literature Reference Citation | MH.CHEM.,130,451(1999) |
| Literature Reference DOI | 10.1007/s007060050204 |
| Molecular Weight | 547.091 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMP733 |