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ISOBATZELLINE-B

View entire compound with spectra: 1 NMR

ISOBATZELLINE-B
SpectraBase Compound ID 8ruoxjy6jDO
InChI InChI=1S/C12H13N3OS/c1-15-10-9-6(12(15)17-2)3-4-14-8(9)5-7(13)11(10)16/h5H,3-4,13H2,1-2H3
InChIKey BWQVVSNLZOCGOQ-UHFFFAOYSA-N
Mol Weight 247.32 g/mol
Molecular Formula C12H13N3OS
Exact Mass 247.077933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8BLG66pAvAe
Name ISOBATZELLINE-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13N3OS
InChI InChI=1S/C12H13N3OS/c1-15-10-9-6(12(15)17-2)3-4-14-8(9)5-7(13)11(10)16/h5H,3-4,13H2,1-2H3
InChIKey BWQVVSNLZOCGOQ-UHFFFAOYSA-N
Literature Reference Author H.H.SUN,S.SAKEMI,N.BURRES,P.MCCARTHY
Literature Reference Citation J.ORG.CHEM.,55,4964(1990)
Literature Reference DOI 10.1021/jo00303a043
Molecular Weight 247.315 g/mol
Solvent CDCl3:CD3OD=1:1
Source File Reference UWED11119