| SpectraBase Compound ID | KCEk4mMjdy3 |
|---|---|
| InChI | InChI=1S/C19H22O3/c1-12(20)19-15-5-3-2-4-13(15)6-8-16(19)14-7-9-17-18(10-14)22-11-21-17/h6-10,13,15-16,19H,2-5,11H2,1H3/t13-,15-,16-,19+/m0/s1 |
| InChIKey | FGKFQAXNAHZARK-QBWPOKONSA-N |
| Mol Weight | 298.38 g/mol |
| Molecular Formula | C19H22O3 |
| Exact Mass | 298.156895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AXukgSJwpVc |
|---|---|
| Name | (rel)-(3R,4R,4aS,8aS)-4.beta.-Acetyl-3-(1,3-benzodioxol-5-yl)-1,4,4a.5,6,7,8,8a.beta.-octahydronaphthalene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H22O3 |
| InChI | InChI=1S/C19H22O3/c1-12(20)19-15-5-3-2-4-13(15)6-8-16(19)14-7-9-17-18(10-14)22-11-21-17/h6-10,13,15-16,19H,2-5,11H2,1H3/t13-,15-,16-,19+/m0/s1 |
| InChIKey | FGKFQAXNAHZARK-QBWPOKONSA-N |
| Molecular Weight | 298.382 g/mol |
| SMILES | [C@]1([C@@](C=C[C@]2([C@@]1(CCCC2)[H])[H])(c1cc2OCOc2cc1)[H])(C(=O)C)[H] |
| SPLASH | splash10-052b-0190000000-a45689c76050128d9355 |
| Source of Spectrum | KC-1992-648-2 |
| Synonyms | (rel)-(3R,4R,4aS,8aS)-4.beta.-Acetyl-3-(1,3-benzodioxol-5-yl)-3,4,4a,5,6,7,8,8a.beta.-octahydronaphthalene (rel)-4.beta.-Acetyl-3-(1,3-benzodioxol-5-yl)-1,4,4a.5,6,7,8,8a.beta.-octahydronaphthalene (rel)-4.beta.-Acetyl-3-(1,3-benzodioxol-5-yl)-3,4,4a,5,6,7,8,8a.beta.-octahydronaphthalene 1-[(1R,2R,4aS,8aS)-2-(1,3-benzodioxol-5-yl)-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]ethanone |
| Wiley ID | 776074 |