For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

REL-(2-R,3-R,3A-S,4-R,6-R)-4-BENZOYLOXY-6-BUTYLOXY-HEXAHYDROISOXAZOLO-[2,3-B]-[1,2]-OXAZINE-2,3-DICARBOXYLIC-ACID-DIMETHYLESTER

View entire compound with spectra: 1 NMR

REL-(2-R,3-R,3A-S,4-R,6-R)-4-BENZOYLOXY-6-BUTYLOXY-HEXAHYDROISOXAZOLO-[2,3-B]-[1,2]-OXAZINE-2,3-DICARBOXYLIC-ACID-DIMETHYLESTER
SpectraBase Compound ID 9NZS1wbnahy
InChI InChI=1S/C21H27NO9/c1-4-5-11-28-15-12-14(29-19(23)13-9-7-6-8-10-13)17-16(20(24)26-2)18(21(25)27-3)31-22(17)30-15/h6-10,14-18H,4-5,11-12H2,1-3H3/t14-,15-,16-,17-,18-/m1/s1
InChIKey QPKRATFHMXWHOM-DUQPFJRNSA-N
Mol Weight 437.45 g/mol
Molecular Formula C21H27NO9
Exact Mass 437.168581 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BmObAvy8vZf
Name REL-(2-R,3-R,3A-S,4-R,6-R)-4-BENZOYLOXY-6-BUTYLOXY-HEXAHYDROISOXAZOLO-[2,3-B]-[1,2]-OXAZINE-2,3-DICARBOXYLIC-ACID-DIMETHYLESTER
Compound Number 44BI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27NO9
InChI InChI=1S/C21H27NO9/c1-4-5-11-28-15-12-14(29-19(23)13-9-7-6-8-10-13)17-16(20(24)26-2)18(21(25)27-3)31-22(17)30-15/h6-10,14-18H,4-5,11-12H2,1-3H3/t14-,15-,16-,17-,18-/m1/s1
InChIKey QPKRATFHMXWHOM-DUQPFJRNSA-N
Literature Reference Author S.E.DENMARK,M.SEIERSTAD,B.HERBERT
Literature Reference Citation J.ORG.CHEM.,64,884(1999)
Literature Reference DOI 10.1021/jo9818374
Molecular Weight 437.447 g/mol
Sample ID 39520
Solvent CDCl3