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SECOBATZELLINE_A
SpectraBase Compound ID LlcutZbP8Yi
InChI InChI=1S/C10H10ClN3O3/c11-6-7(12)5-3(4(16)2-15)1-14-9(5)10(17)8(6)13/h1,4,12,14-16H,2,13H2
InChIKey HKOYUVBHEPHPMA-UHFFFAOYSA-N
Mol Weight 255.66 g/mol
Molecular Formula C10H10ClN3O3
Exact Mass 255.041069 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9POJY91axxI
Name SECOBATZELLINE_A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H10ClN3O3
InChI InChI=1S/C10H10ClN3O3/c11-6-7(12)5-3(4(16)2-15)1-14-9(5)10(17)8(6)13/h1,4,12,14-16H,2,13H2
InChIKey HKOYUVBHEPHPMA-UHFFFAOYSA-N
Literature Reference Author S.P.GUNASEKERA,P.J.MCCARTHY,R.E.LONGLEY,S.A.POMPONI,A.E.WRIG HT
Literature Reference Citation J.NAT.PROD.,62,1208(1999)
Literature Reference DOI 10.1021/np990177a
Molecular Weight 255.661 g/mol
Solvent DMSO-D6
Source File Reference UWMZ2550