![(3S*,3aR*,4S*,7aS*)-3-[4-Methoxy-3-(methoxymethoxy)benzyl]-7-methyleneocta hydro-1H-inden-4-yl acetate](/api/spectrum/FB8Vnb9SP5N/structure.png?h=300&w=458 "(3S*,3aR*,4S*,7aS*)-3-[4-Methoxy-3-(methoxymethoxy)benzyl]-7-methyleneocta hydro-1H-inden-4-yl acetate")
| SpectraBase Compound ID | LhixTbKp5eG |
|---|---|
| InChI | InChI=1S/C22H30O5/c1-14-5-9-20(27-15(2)23)22-17(7-8-18(14)22)11-16-6-10-19(25-4)21(12-16)26-13-24-3/h6,10,12,17-18,20,22H,1,5,7-9,11,13H2,2-4H3/t17-,18+,20-,22+/m0/s1 |
| InChIKey | RWAJDWHYJXXRQE-GXKRZCMTSA-N |
| Mol Weight | 374.48 g/mol |
| Molecular Formula | C22H30O5 |
| Exact Mass | 374.209324 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FB8Vnb9SP5N |
|---|---|
| Name | (3S*,3aR*,4S*,7aS*)-3-[4-Methoxy-3-(methoxymethoxy)benzyl]-7-methyleneocta hydro-1H-inden-4-yl acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30O5 |
| InChI | InChI=1S/C22H30O5/c1-14-5-9-20(27-15(2)23)22-17(7-8-18(14)22)11-16-6-10-19(25-4)21(12-16)26-13-24-3/h6,10,12,17-18,20,22H,1,5,7-9,11,13H2,2-4H3/t17-,18+,20-,22+/m0/s1 |
| InChIKey | RWAJDWHYJXXRQE-GXKRZCMTSA-N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/ml300283f |
| Molecular Weight | 374.477 g/mol |
| Reported Formula | C22H30O5 |
| SMILES | [C@@]1(CC[C@]2([C@@]1([C@](CCC2=C)(OC(C)=O)[H])[H])[H])(Cc1ccc(c(c1)OCOC)OC)[H] |
| SPLASH | splash10-008i-1903000000-744d0d17bdea804e624a |
| Source of Spectrum | MCS-3-SM9-8a |
| Wiley ID | 1864122 |