![(1S,2S,4aS)-(-)-trans-1.alpha.-[(2,5-Dimethoxyphenyl)methyl]-5-(2-methyl-1,3-dioxolan-2-yl)octahydro-1.beta.,2.beta.,4a.beta.-trimethyl-5-(6H)-naphthalenone](/api/spectrum/BTYjyX9WS5u/structure.png?h=300&w=458 "(1S,2S,4aS)-(-)-trans-1.alpha.-[(2,5-Dimethoxyphenyl)methyl]-5-(2-methyl-1,3-dioxolan-2-yl)octahydro-1.beta.,2.beta.,4a.beta.-trimethyl-5-(6H)-naphthalenone")
| SpectraBase Compound ID | 3KbsnHsRBtg |
|---|---|
| InChI | InChI=1S/C24H36O4/c1-17-10-12-23(3)21(7-6-11-24(23)27-13-14-28-24)22(17,2)16-18-15-19(25-4)8-9-20(18)26-5/h8-9,15,17,21H,6-7,10-14,16H2,1-5H3/t17-,21-,22+,23-/m0/s1 |
| InChIKey | SOCXOTPRYWLSOG-QMZRJTEUSA-N |
| Mol Weight | 388.5 g/mol |
| Molecular Formula | C24H36O4 |
| Exact Mass | 388.26136 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BTYjyX9WS5u |
|---|---|
| Name | (1S,2S,4aS)-(-)-trans-1.alpha.-[(2,5-Dimethoxyphenyl)methyl]-5-(2-methyl-1,3-dioxolan-2-yl)octahydro-1.beta.,2.beta.,4a.beta.-trimethyl-5-(6H)-naphthalenone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H36O4 |
| InChI | InChI=1S/C24H36O4/c1-17-10-12-23(3)21(7-6-11-24(23)27-13-14-28-24)22(17,2)16-18-15-19(25-4)8-9-20(18)26-5/h8-9,15,17,21H,6-7,10-14,16H2,1-5H3/t17-,21-,22+,23-/m0/s1 |
| InChIKey | SOCXOTPRYWLSOG-QMZRJTEUSA-N |
| Molecular Weight | 388.548 g/mol |
| SMILES | [C@]12([C@]([C@@](Cc3c(ccc(c3)OC)OC)(C)[C@](CC1)(C)[H])(CCCC21OCCO1)[H])C |
| SPLASH | splash10-0f6t-9830000000-5e1b28d6abbff4305d57 |
| Source of Spectrum | J-61-8778-11 |
| Synonyms | (3'S,4'R,4'aS,8'aS)-4'-[(2,5-dimethoxyphenyl)methyl]-3',4',8'a-trimethylspiro[1,3-dioxolane-2,8'-2,3,4a,5,6,7-hexahydro-1H-naphthalene] (1'R,2'S,4'aS,8'aS)-1'-[(2,5-dimethoxyphenyl)methyl]-1',2',4'a-trimethyl-spiro[1,3-dioxolane-2,5'-decalin] (3'S,4'R,4'aS,8'aS)-4'-[(2,5-dimethoxyphenyl)methyl]-3',4',8'a-trimethyl-spiro[1,3-dioxolane-2,8'-2,3,4a,5,6,7-hexahydro-1H-naphthalene] |
| Wiley ID | 1364045 |