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#8;(2S,3S,3AS,4AS,5R,8S,8AR,2'R)-2-(2'-PHENYLMETHYLOXYTRIDECYL)-5,10,10-TRIMETHYL-5,8-METHANO-OCTAHYDRO-2H-ISOXAZOLO-[3,2-B]-BENZOXAZOLE-3-CARBOXYLIC-ACID-ETHY

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#8;(2S,3S,3AS,4AS,5R,8S,8AR,2'R)-2-(2'-PHENYLMETHYLOXYTRIDECYL)-5,10,10-TRIMETHYL-5,8-METHANO-OCTAHYDRO-2H-ISOXAZOLO-[3,2-B]-BENZOXAZOLE-3-CARBOXYLIC-ACID-ETHY
SpectraBase Compound ID 9VxH3N0qsbL
InChI InChI=1S/C36H57NO5/c1-6-8-9-10-11-12-13-14-18-21-27(40-25-26-19-16-15-17-20-26)24-29-30(34(38)39-7-2)33-37(42-29)31-28-22-23-36(5,32(31)41-33)35(28,3)4/h15-17,19-20,27-33H,6-14,18,21-25H2,1-5H3/t27-,28+,29+,30+,31+,32+,33+,36-/m1/s1
InChIKey GMQPDLNBESHKOX-FAMLGLASSA-N
Mol Weight 583.9 g/mol
Molecular Formula C36H57NO5
Exact Mass 583.423674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GzGB3faPE1Q
Name #8;(2S,3S,3AS,4AS,5R,8S,8AR,2'R)-2-(2'-PHENYLMETHYLOXYTRIDECYL)-5,10,10-TRIMETHYL-5,8-METHANO-OCTAHYDRO-2H-ISOXAZOLO-[3,2-B]-BENZOXAZOLE-3-CARBOXYLIC-ACID-ETHY
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H57NO5
InChI InChI=1S/C36H57NO5/c1-6-8-9-10-11-12-13-14-18-21-27(40-25-26-19-16-15-17-20-26)24-29-30(34(38)39-7-2)33-37(42-29)31-28-22-23-36(5,32(31)41-33)35(28,3)4/h15-17,19-20,27-33H,6-14,18,21-25H2,1-5H3/t27-,28+,29+,30+,31+,32+,33+,36-/m1/s1
InChIKey GMQPDLNBESHKOX-FAMLGLASSA-N
Literature Reference Author O.DIRAT,C.KOUKLOVSKY,Y.LANGLOIS
Literature Reference Citation ORG.LETTERS,1,753(1999)
Literature Reference DOI 10.1021/ol990734k
Molecular Weight 583.852 g/mol
Solvent CDCl3
Source File Reference UWSI26278