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Isothebaine
SpectraBase Compound ID CAQRkODJNNj
InChI InChI=1S/C19H21NO3/c1-20-8-7-12-10-15(23-3)19(21)18-16(12)13(20)9-11-5-4-6-14(22-2)17(11)18/h4-6,10,13,21H,7-9H2,1-3H3
InChIKey RQCOQZNIQLKGTN-UHFFFAOYSA-N
Mol Weight 311.38 g/mol
Molecular Formula C19H21NO3
Exact Mass 311.152144 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4yPDqttNMBa
Name ISOTHEBAINE
Compound Number 15A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21NO3
InChI InChI=1S/C19H21NO3/c1-20-8-7-12-10-15(23-3)19(21)18-16(12)13(20)9-11-5-4-6-14(22-2)17(11)18/h4-6,10,13,21H,7-9H2,1-3H3
InChIKey RQCOQZNIQLKGTN-UHFFFAOYSA-N
Literature Reference Author R.MADEK,O.HUMPA,J.DOSTAL,J.SLAVIK,V.SKLENAR
Literature Reference Citation MAGN.RES.CHEM.,37,195(1999)
Literature Reference DOI 10.1002/(sici)1097-458x(199903)37:3<195::aid-mrc435>3.3.co;2-4
Solvent DMSO-D6
Source File Reference UWSI9099