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MIRABIMIDE-E;(5S,2'R,3'R)-N-(ANTI-8',8',9',9'-TETRACHLORO-3'-(CARBAMOYLOXY)-2'-METHYLDECANOYL)-4-METHOXY-5-METHYL-3-PYRROLIN-2-ONE;LABELED
SpectraBase Compound ID 4OhRN8xGZOu
InChI InChI=1S/C18H26Cl4N2O5/c1-10(15(26)24-11(2)13(28-4)9-14(24)25)12(29-16(23)27)7-5-6-8-18(21,22)17(3,19)20/h9-12H,5-8H2,1-4H3,(H2,23,27)/t10-,11+,12+/m0/s1
InChIKey RYDJXLMYSWZJPD-QJPTWQEYSA-N
Mol Weight 492.2 g/mol
Molecular Formula C18H26Cl4N2O5
Exact Mass 490.059583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DtMOmYSwMWC
Name MIRABIMIDE-E;(5S,2'R,3'R)-N-(ANTI-8',8',9',9'-TETRACHLORO-3'-(CARBAMOYLOXY)-2'-METHYLDECANOYL)-4-METHOXY-5-METHYL-3-PYRROLIN-2-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H26Cl4N2O5
InChI InChI=1S/C18H26Cl4N2O5/c1-10(15(26)24-11(2)13(28-4)9-14(24)25)12(29-16(23)27)7-5-6-8-18(21,22)17(3,19)20/h9-12H,5-8H2,1-4H3,(H2,23,27)/t10-,11+,12+/m0/s1
InChIKey RYDJXLMYSWZJPD-QJPTWQEYSA-N
Literature Reference Author S.PAIK,S.CARMELI,J.CULLINGHAM,R.E.MOORE,G.M.L.PATTERSON,M.A. TIUS
Literature Reference Citation J.AM.CHEM.SOC.,116,8116(1994)
Literature Reference DOI 10.1021/ja00097a019
Molecular Weight 492.227 g/mol
Solvent ACETONE-D6
Source File Reference UWSI101