| SpectraBase Compound ID | GBM4XOUwE71 |
|---|---|
| InChI | InChI=1S/C25H34O4/c1-16-8-7-9-22-24(16,4)13-12-17(2)25(22,5)15-20-14-19(23(27)28-6)10-11-21(20)29-18(3)26/h8,10-11,14,17,22H,7,9,12-13,15H2,1-6H3/t17-,22+,24-,25+/m0/s1 |
| InChIKey | OCNHKNHUOURYDF-SLOKYNNDSA-N |
| Mol Weight | 398.5 g/mol |
| Molecular Formula | C25H34O4 |
| Exact Mass | 398.24571 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3yRahVXnQX4 |
|---|---|
| Name | 5-epi-hyrtiophenol - acetate |
| Alternate Name(s) | 5-epi-(10' S / 10' R)-3-{[1',2',5',10'-Tetramethyl-(octahydro)naphthyl]methyl}-2-acetoxyphenyl-5-carboxylate 3-[[(1R,2S,4aR,8aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-4-acetyloxybenzoic acid methyl ester Methyl 3-[[(1R,2S,4aR,8aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-4-acetyloxybenzoate Methyl 3-[[(1R,2S,4aR,8aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-4-acetoxy-benzoate Methyl 3-[[(1R,2S,4aR,8aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl]-4-acetyloxy-benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H34O4 |
| InChI | InChI=1S/C25H34O4/c1-16-8-7-9-22-24(16,4)13-12-17(2)25(22,5)15-20-14-19(23(27)28-6)10-11-21(20)29-18(3)26/h8,10-11,14,17,22H,7,9,12-13,15H2,1-6H3/t17-,22+,24-,25+/m0/s1 |
| InChIKey | OCNHKNHUOURYDF-SLOKYNNDSA-N |
| Molecular Weight | 398.543 g/mol |
| SMILES | [C@]1([C@]2([C@@](C(C)=CCC2)(C)CC[C@@]1(C)[H])[H])(Cc1c(OC(=O)C)ccc(C(=O)OC)c1)C |
| SPLASH | splash10-0005-9600000000-7625a52ceff9529913a0 |
| Source of Spectrum | G4-63-456-10 |
| Wiley ID | 1608316 |