| SpectraBase Compound ID | AzAkBZYzfd4 |
|---|---|
| InChI | InChI=1S/C16H28O3/c1-10-5-6-13(11(2)15(17)19-4)14-9-16(3,18)8-7-12(10)14/h10-14,18H,5-9H2,1-4H3/t10-,11-,12+,13+,14+,16+/m1/s1 |
| InChIKey | XFVHEMACIHLZEB-XBGPERTJSA-N |
| Mol Weight | 268.4 g/mol |
| Molecular Formula | C16H28O3 |
| Exact Mass | 268.203845 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2Zv44I1peor |
|---|---|
| Name | 2-(7.beta.-Hydroxy-4,7-dimethyl-(1.alpha.-H),2,3,(4.beta.-H),(4a.alpha.-H)-5,6,7,8,(8a.alpha.-H)-decahydronaphrhalen-1-yl)propionic acid methyl ester |
| Alternate Name(s) | (2R)-2-[(1R,4R,4aS,7S,8aS)-7-hydroxy-4,7-dimethyl-2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalen-1-yl]propanoic acid methyl ester Methyl (2R)-2-[(1R,4R,4aS,7S,8aS)-7-hydroxy-4,7-dimethyl-2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalen-1-yl]propanoate Methyl (2R)-2-[(1R,4R,4aS,7S,8aS)-7-hydroxy-4,7-dimethyl-decalin-1-yl]propanoate Methyl (2R)-2-[(1R,4R,4aS,7S,8aS)-4,7-dimethyl-7-oxidanyl-2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalen-1-yl]propanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H28O3 |
| InChI | InChI=1S/C16H28O3/c1-10-5-6-13(11(2)15(17)19-4)14-9-16(3,18)8-7-12(10)14/h10-14,18H,5-9H2,1-4H3/t10-,11-,12+,13+,14+,16+/m1/s1 |
| InChIKey | XFVHEMACIHLZEB-XBGPERTJSA-N |
| Molecular Weight | 268.397 g/mol |
| SMILES | O[C@@]1(C[C@@]2([C@]([C@](C(=O)OC)(C)[H])(CC[C@]([C@@]2(CC1)[H])(C)[H])[H])[H])C |
| SPLASH | splash10-03di-0900000000-f2fe147188ce1970178e |
| Source of Spectrum | KC-60-1136-28 |
| Wiley ID | 1583202 |