| SpectraBase Compound ID | 5xZ0t0fKWVn |
|---|---|
| InChI | InChI=1S/C19H25NO3S/c1-19-9-8-15-14-4-2-12(11-24(20,22)23)10-13(14)3-5-16(15)17(19)6-7-18(19)21/h2,4,10,15-17H,3,5-9,11H2,1H3,(H2,20,22,23)/t15-,16-,17+,19+/m1/s1 |
| InChIKey | UJWKPALRJBMWQO-VXNCWWDNSA-N |
| Mol Weight | 347.47 g/mol |
| Molecular Formula | C19H25NO3S |
| Exact Mass | 347.155515 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AOebxO7d50 |
|---|---|
| Name | Estra-1,3,5(10)-triene-17-one-3-methanesulfonamide |
| Alternate Name(s) | ((8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl)methanesulfonamide [(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]methanesulfonamide [(8R,9S,13S,14S)-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]methanesulfonamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H25NO3S |
| InChI | InChI=1S/C19H25NO3S/c1-19-9-8-15-14-4-2-12(11-24(20,22)23)10-13(14)3-5-16(15)17(19)6-7-18(19)21/h2,4,10,15-17H,3,5-9,11H2,1H3,(H2,20,22,23)/t15-,16-,17+,19+/m1/s1 |
| InChIKey | UJWKPALRJBMWQO-VXNCWWDNSA-N |
| Molecular Weight | 347.473 g/mol |
| SMILES | NS(=O)(=O)Cc1cc2CC[C@]3([C@@]4(CCC([C@]4(CC[C@@]3(c2cc1)[H])C)=O)[H])[H] |
| SPLASH | splash10-014i-0091000000-a452cce3b9cd3b8f080b |
| Source of Spectrum | F5-3-3333-8 |
| Wiley ID | 1732468 |