| SpectraBase Compound ID | Ep9Z7d247mD |
|---|---|
| InChI | InChI=1S/C16H10F7NO3/c1-24(12(25)14(17,18)15(19,20)16(21,22)23)13(26)27-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3 |
| InChIKey | QMPHCBLOSNZCII-UHFFFAOYSA-N |
| Mol Weight | 397.25 g/mol |
| Molecular Formula | C16H10F7NO3 |
| Exact Mass | 397.05489 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KXvCBJOT8QL |
|---|---|
| Name | Carbaryl, N-heptafluorobutyryl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 397.054890324 u |
| Formula | C16H10F7NO3 |
| InChI | InChI=1S/C16H10F7NO3/c1-24(12(25)14(17,18)15(19,20)16(21,22)23)13(26)27-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3 |
| InChIKey | QMPHCBLOSNZCII-UHFFFAOYSA-N |
| Molecular Weight | 397.249 g/mol |
| SMILES | C1=CC=C2C(=C1)C(=CC=C2)OC(=O)N(C)C(C(F)(C(C(F)(F)F)(F)F)F)=O |