| SpectraBase Compound ID | 1y1U2QHScLu |
|---|---|
| InChI | InChI=1S/C43H68O4/c1-30(13-17-34-32(3)15-19-36-40(5,6)23-11-25-42(34,36)9)21-27-46-38(44)29-39(45)47-28-22-31(2)14-18-35-33(4)16-20-37-41(7,8)24-12-26-43(35,37)10/h21-22,34-37H,3-4,11-20,23-29H2,1-2,5-10H3/b30-21+,31-22+/t34-,35-,36?,37?,42+,43+/m0/s1 |
| InChIKey | LJWGOJDJBMDNFY-KHYIFCQTSA-N |
| Mol Weight | 649.0 g/mol |
| Molecular Formula | C43H68O4 |
| Exact Mass | 648.511761 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CbWvTnss7EE |
|---|---|
| Name | BIS-ENT-LABDA-8(17), 13-DIEN-15-YL MALONATE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C43H68O4 |
| InChI | InChI=1S/C43H68O4/c1-30(13-17-34-32(3)15-19-36-40(5,6)23-11-25-42(34,36)9)21-27-46-38(44)29-39(45)47-28-22-31(2)14-18-35-33(4)16-20-37-41(7,8)24-12-26-43(35,37)10/h21-22,34-37H,3-4,11-20,23-29H2,1-2,5-10H3/b30-21+,31-22+/t34-,35-,36?,37?,42+,43+/m0/s1 |
| InChIKey | LJWGOJDJBMDNFY-KHYIFCQTSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |