| SpectraBase Compound ID | FWsq7eR9RBZ |
|---|---|
| InChI | InChI=1S/C7H7Cl/c1-6-3-2-4-7(8)5-6/h2-5H,1H3 |
| InChIKey | OSOUNOBYRMOXQQ-UHFFFAOYSA-N |
| Mol Weight | 126.59 g/mol |
| Molecular Formula | C7H7Cl |
| Exact Mass | 126.023628 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HA2yMAzSKgT |
|---|---|
| Name | 3-CHLOROTOLUOL |
| CAS Registry Number | 108-41-8 |
| Copyright | Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass | 126.023627925 u |
| Formula | C7H7Cl |
| InChI | InChI=1S/C7H7Cl/c1-6-3-2-4-7(8)5-6/h2-5H,1H3 |
| InChIKey | OSOUNOBYRMOXQQ-UHFFFAOYSA-N |
| Molecular Weight | 126.586 g/mol |
| Nominal Mass | 126 u |
| Number of Peaks | 33 |
| SMILES | c1cc(cc(c1)Cl)C |
| SPLASH | splash10-002f-9300000000-dd2a9bc3d633f3137731 |
| Source of Spectrum | Dr. Rolf Kuehnle |
| Synonyms | 1-chloro-3-methylbenzene |
| Technique | GC/MS |
| Wiley ID | WID_MSPA_4240 |