| SpectraBase Compound ID | 2jiaFBDyEK6 |
|---|---|
| InChI | InChI=1S/C23H27Cl3N2O6/c1-3-21(11-34-21)15-8-18-22(14-6-4-5-7-17(14)28(31-2)19(22)29)9-16(13(15)10-32-18)27-20(30)33-12-23(24,25)26/h4-7,13,15-16,18H,3,8-12H2,1-2H3,(H,27,30)/t13-,15?,16?,18-,21-,22+/m1/s1 |
| InChIKey | ZNYGSTKGMMTTFS-HIBYDKGCSA-N |
| Mol Weight | 533.84 g/mol |
| Molecular Formula | C23H27Cl3N2O6 |
| Exact Mass | 532.09347 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4FzNxGcpTyU |
|---|---|
| Name | Epoxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H27Cl3N2O6 |
| InChI | InChI=1S/C23H27Cl3N2O6/c1-3-21(11-34-21)15-8-18-22(14-6-4-5-7-17(14)28(31-2)19(22)29)9-16(13(15)10-32-18)27-20(30)33-12-23(24,25)26/h4-7,13,15-16,18H,3,8-12H2,1-2H3,(H,27,30)/t13-,15?,16?,18-,21-,22+/m1/s1 |
| InChIKey | ZNYGSTKGMMTTFS-HIBYDKGCSA-N |
| Molecular Weight | 533.836 g/mol |
| SMILES | N(C(=O)OCC(Cl)(Cl)Cl)C1[C@@]2(CO[C@@]([C@]3(C(N(OC)c4c3cccc4)=O)C1)(CC2[C@@]1(OC1)CC)[H])[H] |
| SPLASH | splash10-0006-0900000000-bdf2c91e7e4016586517 |
| Source of Spectrum | J-59-4385-17 |
| Wiley ID | 1403543 |