| SpectraBase Spectrum ID |
5YiHnI8iZea |
| Name |
2,2,2-Trichlorethanol |
| CAS Registry Number |
115-20-8 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
147.924947816 u |
| Formula |
C2H3Cl3O |
| InChI |
InChI=1S/C2H3Cl3O/c3-2(4,5)1-6/h6H,1H2 |
| InChIKey |
KPWDGTGXUYRARH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
149.404 g/mol |
| Nominal Mass |
148 u |
| Quality |
845 |
| Retention Index |
864 |
| SMILES |
OCC(Cl)(Cl)Cl |
| SPLASH |
splash10-00pj-9300000000-616f1f0a2c987fdf1407 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Chloralhydrat-M
2,2,2-trichloroethan-1-ol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004111 |
