SpectraBase Compound ID | IFWG59YHWfu |
---|---|
InChI | InChI=1S/C12H13F10NO4/c1-2-23(3-5-26-7(24)9(13,14)11(17,18)19)4-6-27-8(25)10(15,16)12(20,21)22/h2-6H2,1H3 |
InChIKey | DPMZFYXVWLEWJQ-UHFFFAOYSA-N |
Mol Weight | 425.22 g/mol |
Molecular Formula | C12H13F10NO4 |
Exact Mass | 425.06849 g/mol |
SpectraBase Spectrum ID | 4bZ8MAHvMN7 |
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Name | Ethyldiethanolamine, bis(pentafluoropropionate) |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 425.068489529 u |
Formula | C12H13F10NO4 |
InChI | InChI=1S/C12H13F10NO4/c1-2-23(3-5-26-7(24)9(13,14)11(17,18)19)4-6-27-8(25)10(15,16)12(20,21)22/h2-6H2,1H3 |
InChIKey | DPMZFYXVWLEWJQ-UHFFFAOYSA-N |
Molecular Weight | 425.223 g/mol |
SMILES | C(N(CCOC(=O)C(C(F)(F)F)(F)F)CCOC(=O)C(C(F)(F)F)(F)F)C |