| SpectraBase Compound ID | Ec4scVNDblg |
|---|---|
| InChI | InChI=1S/C16F26O3/c17-2(13(33,34)35,1(43)44-16(41,42)14(36,37)38)45-15(39,40)3-7(21,22)4(18)10(27,28)5(19,8(3,23)24)12(31,32)6(20,9(3,25)26)11(4,29)30/t2?,3-,4+,5-,6+ |
| InChIKey | KVHMGLQAZSDIPP-ZMIWAGRTSA-N |
| Mol Weight | 734.13 g/mol |
| Molecular Formula | C16F26O3 |
| Exact Mass | 733.943226 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I8KfKqtnfN8 |
|---|---|
| Name | Perfluoro(ethyl 2-(1-adamantylmethoxy)propionate) |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16F26O3 |
| InChI | InChI=1S/C16F26O3/c17-2(13(33,34)35,1(43)44-16(41,42)14(36,37)38)45-15(39,40)3-7(21,22)4(18)10(27,28)5(19,8(3,23)24)12(31,32)6(20,9(3,25)26)11(4,29)30/t2?,3-,4+,5-,6+ |
| InChIKey | KVHMGLQAZSDIPP-ZMIWAGRTSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Molecular Weight | 734.131 g/mol |
| SMILES | C1(F)(F)[C@]2(C([C@@]3(C(F)(F)[C@](C2(F)F)(C(C1(C3(F)F)C(F)(F)OC(C(=O)OC(F)(F)C(F)(F)F)(F)C(F)(F)F)(F)F)F)F)(F)F)F |
| SPLASH | splash10-014i-0900000000-f04426bee4ab23768640 |
| Source of Spectrum | JP2015193615A |
| Wiley ID | 1852693 |