SpectraBase Compound ID | 2QI60rwavvN |
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InChI | InChI=1S/C7H7Br/c1-6-4-2-3-5-7(6)8/h2-5H,1H3 |
InChIKey | QSSXJPIWXQTSIX-UHFFFAOYSA-N |
Mol Weight | 171.04 g/mol |
Molecular Formula | C7H7Br |
Exact Mass | 169.973113 g/mol |
SpectraBase Spectrum ID | 1I2JInsWEfq |
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Name | ortho-bromotoluene |
Comments | MONAID: JP000177 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H7Br |
InChI | InChI=1S/C7H7Br/c1-6-4-2-3-5-7(6)8/h2-5H,1H3 |
InChIKey | QSSXJPIWXQTSIX-UHFFFAOYSA-N |
Ionization Type | EI-B |
Molecular Weight | 171.037 g/mol |
SMILES | Cc1ccccc1Br |
SPLASH | splash10-006x-9400000000-98d8c917642d347bfe0c |
Source of Spectrum | SRH-2022-177-0 |
Wiley ID | 1822686 |