| SpectraBase Compound ID | D3ap9vASANx |
|---|---|
| InChI | InChI=1S/C12H10F7NO/c13-10(14,11(15,16)12(17,18)19)9(21)20-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,20,21) |
| InChIKey | GLZLEBAUVDLNEX-UHFFFAOYSA-N |
| Mol Weight | 317.21 g/mol |
| Molecular Formula | C12H10F7NO |
| Exact Mass | 317.065061 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5X99Bar3x4a |
|---|---|
| Name | Phenethylamine HFB |
| CAS Registry Number | 29723-29-3 |
| Classification | Chemical |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 317.065061086 u |
| Formula | C12H10F7NO |
| InChI | InChI=1S/C12H10F7NO/c13-10(14,11(15,16)12(17,18)19)9(21)20-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,20,21) |
| InChIKey | GLZLEBAUVDLNEX-UHFFFAOYSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 317.207 g/mol |
| Nominal Mass | 317 u |
| Quality | 994 |
| Retention Index | 1332 |
| SMILES | C(C(C(F)(F)F)(F)F)(C(NCCC1=CC=CC=C1)=O)(F)F |
| SPLASH | splash10-0udl-8900000000-3b6ef6f2189b951b64f6 |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | N-(2-Phenylethyl)-2,2,3,3,4,4,4-heptafluoro-\rbutanamide N-Phenethyl-2,2,3,3,4,4,4-heptafluorobutanamide 2,2,3,3,4,4,4-Heptafluoro-N-phenethyl-butanamide |
| Technique | GC/MS |
| Wiley ID | DD2024_009622 |