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1-ISOBUTYL-5-METHOXY-3,7-DIMETHYL-4,6-DIOXA-2-AZABICYCLO-[3.2.0]-HEPT-2-ENE-7-CARBOXYLIC-ACID-METHYLESTER
SpectraBase Compound ID 6tgg5gZKDWr
InChI InChI=1S/2C13H21NO5/c2*1-8(2)7-12-11(4,10(15)16-5)19-13(12,17-6)18-9(3)14-12/h2*8H,7H2,1-6H3/t11-,12+,13+;11-,12-,13-/m10/s1
InChIKey OYJWSOZMUWVFJL-PDZJBVECSA-N
Mol Weight 542.63 g/mol
Molecular Formula C26H42N2O10
Exact Mass 542.283946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Af6Vdiv2IAa
Name 1-ISOBUTYL-5-METHOXY-3,7-DIMETHYL-4,6-DIOXA-2-AZABICYCLO-[3.2.0]-HEPT-2-ENE-7-CARBOXYLIC-ACID-METHYLESTER
Compound Number 3GA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H42N2O10
InChI InChI=1S/2C13H21NO5/c2*1-8(2)7-12-11(4,10(15)16-5)19-13(12,17-6)18-9(3)14-12/h2*8H,7H2,1-6H3/t11-,12+,13+;11-,12-,13-/m10/s1
InChIKey OYJWSOZMUWVFJL-PDZJBVECSA-N
Literature Reference Author A.G.GRIESBECK,S.BONDOCK
Literature Reference Citation AUSTR.J.CHEM.,61,573(2008)
Literature Reference DOI 10.1071/ch08168
Molecular Weight 542.627 g/mol
Sample ID 41503
Solvent CDCl3