| SpectraBase Compound ID | J6LtaAcu0NV |
|---|---|
| InChI | InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3 |
| InChIKey | IBSQPLPBRSHTTG-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 | 5aw1SM7EQ30 |
|---|---|
| Name | 2-CHLOROTOLUOL |
| CAS Registry Number | 95-49-8 |
| 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/c1-6-4-2-3-5-7(6)8/h2-5H,1H3 |
| InChIKey | IBSQPLPBRSHTTG-UHFFFAOYSA-N |
| Molecular Weight | 126.586 g/mol |
| Nominal Mass | 126 u |
| Number of Peaks | 34 |
| SMILES | c1(c(cccc1)Cl)C |
| SPLASH | splash10-002f-9300000000-66aeedc0c34ec96074b8 |
| Source of Spectrum | Dr. Rolf Kuehnle |
| Synonyms | 1-chloro-2-methylbenzene |
| Technique | GC/MS |
| Wiley ID | WID_MSPA_4253 |