![2-[(2,2,3,3,4,4,4-Heptafluorobutanoyl)amino]-1-methyl-3-oxo-3-propoxypropyl 2,2,3,3,4,4,4-heptafluorobutanoate](/api/spectrum/cjMWSi2aQC/structure.png?h=300&w=458 "2-[(2,2,3,3,4,4,4-Heptafluorobutanoyl)amino]-1-methyl-3-oxo-3-propoxypropyl 2,2,3,3,4,4,4-heptafluorobutanoate")
| SpectraBase Compound ID | J9OQqDdo9E |
|---|---|
| InChI | InChI=1S/C15H13F14NO5/c1-3-4-34-7(31)6(30-8(32)10(16,17)12(20,21)14(24,25)26)5(2)35-9(33)11(18,19)13(22,23)15(27,28)29/h5-6H,3-4H2,1-2H3,(H,30,32) |
| InChIKey | FMFIEPZGTQWMRR-UHFFFAOYSA-N |
| Mol Weight | 553.25 g/mol |
| Molecular Formula | C15H13F14NO5 |
| Exact Mass | 553.057017 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | cjMWSi2aQC |
|---|---|
| Name | 2-[(2,2,3,3,4,4,4-Heptafluorobutanoyl)amino]-1-methyl-3-oxo-3-propoxypropyl 2,2,3,3,4,4,4-heptafluorobutanoate |
| CAS Registry Number | 70771-93-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H13F14NO5 |
| InChI | InChI=1S/C15H13F14NO5/c1-3-4-34-7(31)6(30-8(32)10(16,17)12(20,21)14(24,25)26)5(2)35-9(33)11(18,19)13(22,23)15(27,28)29/h5-6H,3-4H2,1-2H3,(H,30,32) |
| InChIKey | FMFIEPZGTQWMRR-UHFFFAOYSA-N |
| Molecular Weight | 553.249 g/mol |
| SMILES | N(C(C(OCCC)=O)C(C)OC(=O)C(F)(F)C(F)(F)C(F)(F)F)C(=O)C(F)(F)C(F)(F)C(F)(F)F |
| SPLASH | splash10-0udi-4190000000-ead22177cc7f9f1d51ac |
| Source of Spectrum | W5-1989-6803-1 |
| Synonyms | N,O-Bis(heptafluorobutyryl)threonine propyl ester 2,2,3,3,4,4,4-heptafluorobutanoic acid [3-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]-4-oxo-4-propoxybutan-2-yl] ester [3-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-4-oxo-4-propoxybutan-2-yl] 2,2,3,3,4,4,4-heptafluorobutanoate [2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-1-methyl-3-oxo-3-propoxy-propyl] 2,2,3,3,4,4,4-heptafluorobutanoate [3-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoylamino]-4-oxidanylidene-4-propoxy-butan-2-yl] 2,2,3,3,4,4,4-heptakis(fluoranyl)butanoate |
| Wiley ID | 1406048 |