| SpectraBase Compound ID | 9KN7j0gc212 |
|---|---|
| InChI | InChI=1S/C23H32O3/c1-15-7-6-8-21-22(15,4)12-11-16(2)23(21,5)14-18-13-19(26-17(3)24)9-10-20(18)25/h7,9-10,13,16,21,25H,6,8,11-12,14H2,1-5H3/t16-,21?,22+,23+/m0/s1 |
| InChIKey | DRSPVCXBVVVLIJ-CEDFZDNYSA-N |
| Mol Weight | 356.5 g/mol |
| Molecular Formula | C23H32O3 |
| Exact Mass | 356.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3gSrVyYiTw |
|---|---|
| Name | Avarol-monoacetate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H32O3 |
| InChI | InChI=1S/C23H32O3/c1-15-7-6-8-21-22(15,4)12-11-16(2)23(21,5)14-18-13-19(26-17(3)24)9-10-20(18)25/h7,9-10,13,16,21,25H,6,8,11-12,14H2,1-5H3/t16-,21?,22+,23+/m0/s1 |
| InChIKey | DRSPVCXBVVVLIJ-CEDFZDNYSA-N |
| Molecular Weight | 356.506 g/mol |
| SMILES | Oc1c(C[C@]2(C3[C@](C(C)=CCC3)(C)CC[C@@]2(C)[H])C)cc(OC(=O)C)cc1 |
| SPLASH | splash10-052g-4901000000-0d4de7d80345af5681e9 |
| Source of Spectrum | X2-52-647-2 |
| Synonyms | Acetic acid [3-[[(1R,2S,4aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-4-hydroxyphenyl] ester [3-[[(1R,2S,4aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-4-hydroxyphenyl] acetate [3-[[(1R,2S,4aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-4-hydroxy-phenyl] acetate [3-[[(1R,2S,4aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-4-oxidanyl-phenyl] ethanoate |
| Wiley ID | 1603112 |