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6-(6'-METHYL-5',6',7',8'-TETRAHYDRO-1',3'-DIOXOLO-[4,5-G]-ISOQUINOLIN-5'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;(BICUCULLINE)24

View entire compound with spectra: 3 NMR, and 1 MS (GC)

6-(6'-METHYL-5',6',7',8'-TETRAHYDRO-1',3'-DIOXOLO-[4,5-G]-ISOQUINOLIN-5'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;(BICUCULLINE)24
SpectraBase Compound ID F6LONt5qexT
InChI InChI=1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17-,18-/m0/s1
InChIKey IYGYMKDQCDOMRE-ROUUACIJSA-N
Mol Weight 367.36 g/mol
Molecular Formula C20H17NO6
Exact Mass 367.105587 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9WbfavAuTJm
Name BICUCULLINE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H17NO6
InChI InChI=1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17-,18-/m0/s1
InChIKey IYGYMKDQCDOMRE-ROUUACIJSA-N
Literature Reference Author R.MAREK,J.MAREK,J.DOSTAL,E.TABORSKA,J.SLAVIK,R.DOMMISSE
Literature Reference Citation MAGN.RES.CHEM.,40,687(2002)
Literature Reference DOI 10.1002/mrc.1084
Solvent DMSO-D6
Source File Reference UWMZ23136