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REL-(3AR,7AR,8R)-METHYL-2Z-5-[8-(3-METHYL-2-OXIDO-3A,4,5,6,7,7A-HEXAHYDRO-4H-1,2-BENZOXAZINYL)]-2-PENTENOATE
SpectraBase Compound ID HmzvHgJxUP
InChI InChI=1S/C15H23NO4/c1-11-12-7-3-4-8-13(12)14(20-16(11)18)9-5-6-10-15(17)19-2/h6,10,12-14H,3-5,7-9H2,1-2H3/b10-6-/t12-,13+,14+/m1/s1
InChIKey CZHNXMSQNCLMTJ-GWTXEIDUSA-N
Mol Weight 281.35 g/mol
Molecular Formula C15H23NO4
Exact Mass 281.162708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CRphSFfQrfh
Name REL-(3AR,7AR,8R)-METHYL-2Z-5-[8-(3-METHYL-2-OXIDO-3A,4,5,6,7,7A-HEXAHYDRO-4H-1,2-BENZOXAZINYL)]-2-PENTENOATE
Compound Number 41
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H23NO4
InChI InChI=1S/C15H23NO4/c1-11-12-7-3-4-8-13(12)14(20-16(11)18)9-5-6-10-15(17)19-2/h6,10,12-14H,3-5,7-9H2,1-2H3/b10-6-/t12-,13+,14+/m1/s1
InChIKey CZHNXMSQNCLMTJ-GWTXEIDUSA-N
Literature Reference Author S.E.DENMARK,L.GOMEZ
Literature Reference Citation J.ORG.CHEM.,68,8015(2003)
Literature Reference DOI 10.1021/jo034853w
Molecular Weight 281.352 g/mol
Solvent CDCl3
Source File Reference UWVN20754