| SpectraBase Compound ID | IOSid7MhvNk |
|---|---|
| InChI | InChI=1S/C7H5Cl3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H |
| InChIKey | XEMRAKSQROQPBR-UHFFFAOYSA-N |
| Mol Weight | 195.48 g/mol |
| Molecular Formula | C7H5Cl3 |
| Exact Mass | 193.945683 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JI7GfVBHROy |
|---|---|
| Name | Trichloromethylbenzene |
| CAS Registry Number | 98-07-7 |
| Classification | Chemical |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 193.945683261 u |
| Formula | C7H5Cl3 |
| InChI | InChI=1S/C7H5Cl3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H |
| InChIKey | XEMRAKSQROQPBR-UHFFFAOYSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 195.476 g/mol |
| Nominal Mass | 194 u |
| Quality | 940 |
| Retention Index | 1256 |
| SMILES | C(C=1C=CC=CC1)(Cl)(Cl)Cl |
| SPLASH | splash10-0bt9-3900000000-2ffba21d9cf2abd72cfe |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | (trichloromethyl)benzene |
| Technique | GC/MS |
| Wiley ID | DD2024_004113 |