![(2R,3R,7R,8S)-8-Chloro-2,3-dimethoxy-2,3-dimethyl-2,3,4a,5,6,8a-hexahydro-benzo[1,4]dioxine](/api/spectrum/ChE9wWiLjHO/structure.png?h=300&w=458 "(2R,3R,7R,8S)-8-Chloro-2,3-dimethoxy-2,3-dimethyl-2,3,4a,5,6,8a-hexahydro-benzo[1,4]dioxine")
| SpectraBase Compound ID | BQkB6JypxMd |
|---|---|
| InChI | InChI=1S/C12H19ClO4/c1-11(14-3)12(2,15-4)17-10-8(13)6-5-7-9(10)16-11/h6,9-10H,5,7H2,1-4H3/t9-,10-,11+,12+/m0/s1 |
| InChIKey | ROKAOAVIKYZRQW-NNYUYHANSA-N |
| Mol Weight | 262.73 g/mol |
| Molecular Formula | C12H19ClO4 |
| Exact Mass | 262.097187 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ChE9wWiLjHO |
|---|---|
| Name | (2R,3R,7R,8S)-8-Chloro-2,3-dimethoxy-2,3-dimethyl-2,3,4a,5,6,8a-hexahydro-benzo[1,4]dioxine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H19ClO4 |
| InChI | InChI=1S/C12H19ClO4/c1-11(14-3)12(2,15-4)17-10-8(13)6-5-7-9(10)16-11/h6,9-10H,5,7H2,1-4H3/t9-,10-,11+,12+/m0/s1 |
| InChIKey | ROKAOAVIKYZRQW-NNYUYHANSA-N |
| Molecular Weight | 262.733 g/mol |
| SMILES | [C@@]1(O[C@@]2([C@@](O[C@]1(OC)C)(CCC=C2Cl)[H])[H])(OC)C |
| SPLASH | splash10-0h00-4920000000-4713d45c627d607296fa |
| Source of Spectrum | F5-3-1084-7 |
| Synonyms | 8-Chloro-2,3,4a,5,6,8a-hexahydro-2,3-dimethoxy-2,3-dimethylbenzo[b]-[1,4]-dioxine (2R,3R,4aS,8aR)-8-chloro-2,3-dimethoxy-2,3-dimethyl-2,3,4a,5,6,8a-hexahydrobenzo[b][1,4]dioxine (2R,3R,4aR,8aS)-5-chloro-2,3-dimethoxy-2,3-dimethyl-4a,7,8,8a-tetrahydro-1,4-benzodioxine (2R,3R,4aR,8aS)-5-chloranyl-2,3-dimethoxy-2,3-dimethyl-4a,7,8,8a-tetrahydro-1,4-benzodioxine |
| Wiley ID | 1732221 |