| SpectraBase Compound ID | 7Qn9Le6sooX |
|---|---|
| InChI | InChI=1S/C27H37NO4S/c1-4-14-28(15-5-2)33(29,30)19-20-6-8-22-21(18-20)7-9-24-23(22)10-12-26(3)25(24)11-13-27(26)31-16-17-32-27/h4-6,8,18,23-25H,1-2,7,9-17,19H2,3H3/t23-,24-,25+,26+/m1/s1 |
| InChIKey | HSBUIJPLUVNBMG-XPGKHFPBSA-N |
| Mol Weight | 471.7 g/mol |
| Molecular Formula | C27H37NO4S |
| Exact Mass | 471.24433 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1VaPjPKjVw |
|---|---|
| Name | N,N-Diallyl-17,17-(ethylenedioxy)-estra-1,3,5(10)-triene-3-methanesulfonamide |
| Alternate Name(s) | N,N-diallyl-1-((8R,9S,13S,14S)-13-methyl-6,7,8,9,11,12,13,14,15,16-decahydrospiro[cyclopenta[a]phenanthrene-17,2'-[1,3]dioxolan]-3-yl)methanesulfonamide 1-[(8'R,9'S,13'S,14'S)-13'-methyl-3'-spiro[1,3-dioxolane-2,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]yl]-N,N-bis(prop-2-enyl)methanesulfonamide 1-[(8'R,9'S,13'S,14'S)-13'-methylspiro[1,3-dioxolane-2,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]-3'-yl]-N,N-bis(prop-2-enyl)methanesulfonamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H37NO4S |
| InChI | InChI=1S/C27H37NO4S/c1-4-14-28(15-5-2)33(29,30)19-20-6-8-22-21(18-20)7-9-24-23(22)10-12-26(3)25(24)11-13-27(26)31-16-17-32-27/h4-6,8,18,23-25H,1-2,7,9-17,19H2,3H3/t23-,24-,25+,26+/m1/s1 |
| InChIKey | HSBUIJPLUVNBMG-XPGKHFPBSA-N |
| Molecular Weight | 471.656 g/mol |
| SMILES | C(N(S(Cc1cc2CC[C@]3([C@@]4(CCC5([C@]4(CC[C@@]3(c2cc1)[H])C)OCCO5)[H])[H])(=O)=O)CC=C)C=C |
| SPLASH | splash10-03dj-7009200000-31c21b0bb7867dcfb262 |
| Source of Spectrum | F5-3-3333-15 |
| Wiley ID | 1732466 |