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Methyl 6-bromo-3-cyano-3a-(3-methyl-2-buten-1-yl)-2-oxo-2,3,3a,8a-tetrahydro-8H-furo[2,3-b]indole-8-carboxylate
SpectraBase Compound ID 4F7ECaNeylI
InChI InChI=1S/C18H17BrN2O4/c1-10(2)6-7-18-12-5-4-11(19)8-14(12)21(17(23)24-3)16(18)25-15(22)13(18)9-20/h4-6,8,13,16H,7H2,1-3H3/t13?,16-,18+/m0/s1
InChIKey GLZOOHYCHVCMFK-VQGXLBNPSA-N
Mol Weight 405.25 g/mol
Molecular Formula C18H17BrN2O4
Exact Mass 404.03717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1wNx0NGyQGZ
Name METHYL-6-BROMO-3-CYANO-3A-(3-METHYL-2-BUTEN-1-YL)-2-OXO-2,3,3A,8A-TETRAHYDRO-8H-FURO-[2,3-B]-INDOLE-8-CARBOXYLATE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17BrN2O4
InChI InChI=1S/C18H17BrN2O4/c1-10(2)6-7-18-12-5-4-11(19)8-14(12)21(17(23)24-3)16(18)25-15(22)13(18)9-20/h4-6,8,13,16H,7H2,1-3H3/t13?,16-,18+/m0/s1
InChIKey GLZOOHYCHVCMFK-VQGXLBNPSA-N
Literature Reference Author M.S.MORALES-RIOS,O.R.SUAREZ-CASTILLO,P.JOSEPH-NATHAN
Literature Reference Citation J.ORG.CHEM.,64,1086(1999)
Literature Reference DOI 10.1021/jo982090k
Molecular Weight 405.248 g/mol
Sample ID 39301
Solvent DMSO-D6