| SpectraBase Compound ID | 6OjfxtjZheE |
|---|---|
| InChI | InChI=1S/C18H19BrO3/c1-12-8-10-13(11-9-12)18(21-3)17(19)16(20-2)14-6-4-5-7-15(14)22-18/h4-11,16-17H,1-3H3/t16-,17-,18-/m0/s1 |
| InChIKey | RRIAPZDZMPPPOX-BZSNNMDCSA-N |
| Mol Weight | 363.25 g/mol |
| Molecular Formula | C18H19BrO3 |
| Exact Mass | 362.051757 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4J9AN3tBse |
|---|---|
| Name | 3-Bromo-2,4-bis(methoxy)-2-(4'-methylphenyl)chromane |
| Alternate Name(s) | (2S,3S,4S)-3-Bromo-2,4-dimethoxy-2-p-tolyl-chroman 3-Bromo-2,4-dimethoxy-2-(4-methylphenyl)chromane (2S,3S,4S)-3-bromo-2,4-dimethoxy-2-(4-methylphenyl)-3,4-dihydro-2H-1-benzopyran (2S,3S,4S)-3-bromo-2,4-dimethoxy-2-(4-methylphenyl)-3,4-dihydrochromene (2S,3S,4S)-3-bromo-2,4-dimethoxy-2-(p-tolyl)chromane (2S,3S,4S)-3-bromanyl-2,4-dimethoxy-2-(4-methylphenyl)-3,4-dihydrochromene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H19BrO3 |
| InChI | InChI=1S/C18H19BrO3/c1-12-8-10-13(11-9-12)18(21-3)17(19)16(20-2)14-6-4-5-7-15(14)22-18/h4-11,16-17H,1-3H3/t16-,17-,18-/m0/s1 |
| InChIKey | RRIAPZDZMPPPOX-BZSNNMDCSA-N |
| Molecular Weight | 363.251 g/mol |
| SMILES | [C@]1([C@]([C@@](OC)(c2c(O1)cccc2)[H])(Br)[H])(c1ccc(cc1)C)OC |
| SPLASH | splash10-0a4r-0972000000-b1ddca8e4502722a70ba |
| Source of Spectrum | SK-26-3072-10 |
| Wiley ID | 867231 |