| SpectraBase Compound ID | Gm3qStzyRrZ |
|---|---|
| InChI | InChI=1S/C27H40O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-10,13,15,17-19,22-25H,6-8,11-12,14,16H2,1-5H3 |
| InChIKey | NIJCHQWGAFQPFT-UHFFFAOYSA-N |
| Mol Weight | 380.6 g/mol |
| Molecular Formula | C27H40O |
| Exact Mass | 380.307916 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8INfUKaX8yG |
|---|---|
| Name | Cholesta-1,4,6-triene-3-one |
| CAS Registry Number | 3464-60-6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C27H40O |
| InChI | InChI=1S/C27H40O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-10,13,15,17-19,22-25H,6-8,11-12,14,16H2,1-5H3 |
| InChIKey | NIJCHQWGAFQPFT-UHFFFAOYSA-N |
| Instrument Name | Bruker WH-90 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |