| SpectraBase Compound ID | JuyDKLJS2HF |
|---|---|
| InChI | InChI=1S/C27H43NO3/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-23,25,29,31H,4-14H2,1-3H3/t15-,16-,17+,18+,19-,20-,21-,22-,23+,25-,26+,27-/m0/s1 |
| InChIKey | IQDIERHFZVCNRZ-YUYPDVIUSA-N |
| Mol Weight | 429.6 g/mol |
| Molecular Formula | C27H43NO3 |
| Exact Mass | 429.324294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EM2gbOfRgK6 |
|---|---|
| Name | VERTICINONE |
| CAS Registry Number | 18059-10-4 |
| Compound Number | 251 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H43NO3 |
| InChI | InChI=1S/C27H43NO3/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-23,25,29,31H,4-14H2,1-3H3/t15-,16-,17+,18+,19-,20-,21-,22-,23+,25-,26+,27-/m0/s1 |
| InChIKey | IQDIERHFZVCNRZ-YUYPDVIUSA-N |
| Literature Reference Author | T.A.BROADBENT,E.G.PAUL |
| Literature Reference Citation | HETEROCYCLES,20,863(1983) |
| Literature Reference DOI | 10.3987/R-1983-05-0863 |
| Molecular Weight | 429.643 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW13231 |