| SpectraBase Spectrum ID |
3qb2qIfToO |
| Name |
1,3-Benzodioxole, 5-[5-(4-ethoxy-3-methoxyphenyl)tetrahydro-3,4-dimethyl-2-furanyl]-, [2S-(2.alpha.,3.beta.,4.beta.,5.beta.)]- |
| Alternate Name(s) |
1,3-Benzodioxole
5-[(2S,3S,4R,5S)-5-(4-ethoxy-3-methoxyphenyl)-3,4-dimethyltetrahydro-2-furanyl]-1,3-benzodioxole
Chicanine ethyl ether |
| CAS Registry Number |
78868-98-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26O5 |
| InChI |
InChI=1S/C22H26O5/c1-5-24-17-8-6-15(10-19(17)23-4)21-13(2)14(3)22(27-21)16-7-9-18-20(11-16)26-12-25-18/h6-11,13-14,21-22H,5,12H2,1-4H3/t13-,14+,21+,22+/m1/s1 |
| InChIKey |
GBOIXEFJANHEQI-RUGJYQHNSA-N |
| Molecular Weight |
370.445 g/mol |
| SMILES |
[C@]1(O[C@@]([C@@]([C@@]1(C)[H])(C)[H])(c1cc(OC)c(cc1)OCC)[H])(c1cc2OCOc2cc1)[H] |
| SPLASH |
splash10-006x-0951000000-d94f36111c7ce2f5ea32 |
| Source of Spectrum |
I-59-1683-0 |
| Wiley ID |
1354464 |
![1,3-Benzodioxole, 5-[5-(4-ethoxy-3-methoxyphenyl)tetrahydro-3,4-dimethyl-2-furanyl]-, [2S-(2.alpha.,3.beta.,4.beta.,5.beta.)]-](/api/spectrum/3qb2qIfToO/structure.png?h=300&w=458 "1,3-Benzodioxole, 5-[5-(4-ethoxy-3-methoxyphenyl)tetrahydro-3,4-dimethyl-2-furanyl]-, [2S-(2.alpha.,3.beta.,4.beta.,5.beta.)]-")
