| SpectraBase Compound ID | CgX79QvvXMM |
|---|---|
| InChI | InChI=1S/C7H7Br/c1-6-3-2-4-7(8)5-6/h2-5H,1H3 |
| InChIKey | WJIFKOVZNJTSGO-UHFFFAOYSA-N |
| Mol Weight | 171.04 g/mol |
| Molecular Formula | C7H7Br |
| Exact Mass | 169.973113 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8BgDoNmS010 |
|---|---|
| Name | 3-Bromo-toluene |
| CAS Registry Number | 591-17-3 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H7Br |
| InChI | InChI=1S/C7H7Br/c1-6-3-2-4-7(8)5-6/h2-5H,1H3 |
| InChIKey | WJIFKOVZNJTSGO-UHFFFAOYSA-N |
| Instrument Name | SF = 090 MHz |
| Literature Reference | J. Org. Chem. 46, 4219 (1981). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |