![1-Bromanyl-2-[(1S)-1-methoxyethyl]benzene](/api/spectrum/7HkFnGwYLmP/structure.png?h=300&w=458 "1-Bromanyl-2-[(1S)-1-methoxyethyl]benzene")
| SpectraBase Compound ID | 3pSI499uch8 |
|---|---|
| InChI | InChI=1S/C9H11BrO/c1-7(11-2)8-5-3-4-6-9(8)10/h3-7H,1-2H3/t7-/m0/s1 |
| InChIKey | ARONTLUOKIMGCG-ZETCQYMHSA-N |
| Mol Weight | 215.09 g/mol |
| Molecular Formula | C9H11BrO |
| Exact Mass | 213.999328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7HkFnGwYLmP |
|---|---|
| Name | 1-Bromanyl-2-[(1S)-1-methoxyethyl]benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.999327973 u |
| Formula | C9H11BrO |
| InChI | InChI=1S/C9H11BrO/c1-7(11-2)8-5-3-4-6-9(8)10/h3-7H,1-2H3/t7-/m0/s1 |
| InChIKey | ARONTLUOKIMGCG-ZETCQYMHSA-N |
| Molecular Weight | 215.090 g/mol |
| SMILES | C=1(C(Br)=CC=CC1)[C@@](OC)(C)[H] |