SpectraBase Compound ID | KqeXuqN6rYH |
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InChI | InChI=1S/C21H31F3O5/c1-2-3-12-20(29,21(22,23)24)13-8-10-16-15(17(25)14-18(16)26)9-6-4-5-7-11-19(27)28/h4,6,8,10,15-16,18,26,29H,2-3,5,7,9,11-14H2,1H3,(H,27,28)/b6-4+,10-8+ |
InChIKey | WCQZTKXGUDCWSV-ONNLMXTPSA-N |
Mol Weight | 420.47 g/mol |
Molecular Formula | C21H31F3O5 |
Exact Mass | 420.212359 g/mol |
SpectraBase Spectrum ID | B61TWEpv2op |
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Name | DL-15-Deoxy-16-hydroxy-16-(trifluoromethyl)-prostaglandin-E2,epimer-1 |
CAS Registry Number | 73397-60-1 |
Comments | broad-band decoupling (BB) |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C21H31F3O5 |
InChI | InChI=1S/C21H31F3O5/c1-2-3-12-20(29,21(22,23)24)13-8-10-16-15(17(25)14-18(16)26)9-6-4-5-7-11-19(27)28/h4,6,8,10,15-16,18,26,29H,2-3,5,7,9,11-14H2,1H3,(H,27,28)/b6-4+,10-8+ |
InChIKey | WCQZTKXGUDCWSV-ONNLMXTPSA-N |
Instrument Name | SF = 080 MHz |
Literature Reference | J. Org. Chem. 45, 2278 (1980). |
NMR Standard | not reported |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |