| SpectraBase Compound ID | 1S0KqBYO9gp |
|---|---|
| InChI | InChI=1S/C7H12O3.CHF3/c1-7(2,9)5-3-4-10-6(5)8;2-1(3)4/h5,9H,3-4H2,1-2H3;1H |
| InChIKey | GGTRLDDSIOUZQM-UHFFFAOYSA-N |
| Mol Weight | 214.18 g/mol |
| Molecular Formula | C8H13F3O3 |
| Exact Mass | 214.081679 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DEGWOnVt5PQ |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H11O3F3 |
| InChI | InChI=1S/C7H12O3.CHF3/c1-7(2,9)5-3-4-10-6(5)8;2-1(3)4/h5,9H,3-4H2,1-2H3;1H |
| InChIKey | GGTRLDDSIOUZQM-UHFFFAOYSA-N |
| Molecular Weight | 214.0813 |
| SMILES | C(F)(F)F.OC(C)(C)C1C(=O)OCC1 |
| SPLASH | splash10-052f-9000000000-86d2058cd90424e3cc30 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |