| SpectraBase Compound ID | 8C7BgJMeu3U |
|---|---|
| InChI | InChI=1S/C17H6F10O4/c1-3(31-17(29)5-8(20)12(24)15(27)13(25)9(5)21)2-30-16(28)4-6(18)10(22)14(26)11(23)7(4)19/h3H,2H2,1H3 |
| InChIKey | MVMQZMZSAXJKNF-UHFFFAOYSA-N |
| Mol Weight | 464.22 g/mol |
| Molecular Formula | C17H6F10O4 |
| Exact Mass | 464.01064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2L71vVKrXwW |
|---|---|
| Name | Propylene glycol 2pfp |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 464.010640299 u |
| Formula | C17H6F10O4 |
| InChI | InChI=1S/C17H6F10O4/c1-3(31-17(29)5-8(20)12(24)15(27)13(25)9(5)21)2-30-16(28)4-6(18)10(22)14(26)11(23)7(4)19/h3H,2H2,1H3 |
| InChIKey | MVMQZMZSAXJKNF-UHFFFAOYSA-N |
| Molecular Weight | 464.215 g/mol |
| SMILES | C=1(C(=C(C(=C(C1F)F)F)F)F)C(OC(COC(C1=C(C(=C(C(=C1F)F)F)F)F)=O)C)=O |