| SpectraBase Compound ID | 4YrxoYD5K0k |
|---|---|
| InChI | InChI=1S/C30H50O6/c1-25(2)14-17-16-8-9-19-27(5)12-11-20(32)26(3,4)18(27)10-13-28(19,6)29(16,7)22(34)24(36)30(17,15-31)23(35)21(25)33/h8,17-24,31-36H,9-15H2,1-7H3/t17-,18?,19?,20?,21-,22-,23-,24-,27?,28?,29-,30+/m1/s1 |
| InChIKey | DZVVEETZRZUXLI-AOFITBCBSA-N |
| Mol Weight | 506.7 g/mol |
| Molecular Formula | C30H50O6 |
| Exact Mass | 506.360739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DLO3mOf1rtS |
|---|---|
| Name | R-1-Barrigenol |
| CAS Registry Number | 15399-43-6 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C30H50O6 |
| InChI | InChI=1S/C30H50O6/c1-25(2)14-17-16-8-9-19-27(5)12-11-20(32)26(3,4)18(27)10-13-28(19,6)29(16,7)22(34)24(36)30(17,15-31)23(35)21(25)33/h8,17-24,31-36H,9-15H2,1-7H3/t17-,18?,19?,20?,21-,22-,23-,24-,27?,28?,29-,30+/m1/s1 |
| InChIKey | DZVVEETZRZUXLI-AOFITBCBSA-N |
| Instrument Name | SF = 250 MHz |
| Literature Reference | J. Nat. Products 49, 650 (1986). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |