| SpectraBase Compound ID | Hi9QMmsMlf4 |
|---|---|
| InChI | InChI=1S/C11H13BrO2/c1-7-4-11(12)5-10(8(7)2)6-14-9(3)13/h4-5H,6H2,1-3H3 |
| InChIKey | CZFLJDXSJQKZST-UHFFFAOYSA-N |
| Mol Weight | 257.13 g/mol |
| Molecular Formula | C11H13BrO2 |
| Exact Mass | 256.009893 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BJWBbXeDWgv |
|---|---|
| Name | 5-Bromo-2,3-dimethylbenzyl acetate |
| CAS Registry Number | 104532-01-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H13BrO2 |
| InChI | InChI=1S/C11H13BrO2/c1-7-4-11(12)5-10(8(7)2)6-14-9(3)13/h4-5H,6H2,1-3H3 |
| InChIKey | CZFLJDXSJQKZST-UHFFFAOYSA-N |
| Molecular Weight | 257.127 g/mol |
| SMILES | c1(c(c(C)cc(c1)Br)C)COC(=O)C |
| SPLASH | splash10-0002-0900000000-2e042be6e493f957da97 |
| Source of Spectrum | J-51-4548-0 |
| Wiley ID | 1259276 |