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1-METHOXYDISCORHABDIN_D
SpectraBase Compound ID HNpcc13YWtq
InChI InChI=1S/C19H15N3O3S/c1-25-18-15-8(23)4-9-19(18)5-10(26-9)21-14-12(19)16-11-7(2-3-22(15)16)6-20-13(11)17(14)24/h4,6,10,15,18H,2-3,5H2,1H3,(H,20,21,24)/p+1
InChIKey TYPMFNKWGPMUPQ-UHFFFAOYSA-O
Mol Weight 366.42 g/mol
Molecular Formula C19H16N3O3S
Exact Mass 366.091238 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5C0daRlI0NP
Name 1-METHOXYDISCORHABDIN_D
Compound Number 12
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H16N3O3S
InChI InChI=1S/C19H15N3O3S/c1-25-18-15-8(23)4-9-19(18)5-10(26-9)21-14-12(19)16-11-7(2-3-22(15)16)6-20-13(11)17(14)24/h4,6,10,15,18H,2-3,5H2,1H3,(H,20,21,24)/p+1
InChIKey TYPMFNKWGPMUPQ-UHFFFAOYSA-O
Literature Reference Author E.M.ANTUNES,D.R.BEUKES,M.KELLY,T.SAMAAI,L.R.BARROWS,K.M.MARS HALL,C.SINCICH,M.T.D
Literature Reference Citation J.NAT.PROD.,67,1268(2004)
Literature Reference DOI 10.1021/np034084b
Molecular Weight 366.414 g/mol
Solvent DMSO-D6
Source File Reference UWMZ7311