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7-CHLORO-1-O-METHYLEMODIN

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7-CHLORO-1-O-METHYLEMODIN
SpectraBase Compound ID HAVsjTJw7fV
InChI InChI=1S/C16H11ClO5/c1-6-3-7-11(10(4-6)22-2)15(20)12-8(14(7)19)5-9(18)13(17)16(12)21/h3-5,18,21H,1-2H3
InChIKey CLRXTBMRGOWHGZ-UHFFFAOYSA-N
Mol Weight 318.71 g/mol
Molecular Formula C16H11ClO5
Exact Mass 318.029501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LH39SNPtabQ
Name 7-CHLORO-1-0-METHYLEMODIN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11ClO5
InChI InChI=1S/C16H11ClO5/c1-6-3-7-11(10(4-6)22-2)15(20)12-8(14(7)19)5-9(18)13(17)16(12)21/h3-5,18,21H,1-2H3
InChIKey CLRXTBMRGOWHGZ-UHFFFAOYSA-N
Literature Reference Author P.A.COHEN,G.H.N.TOWERS
Literature Reference Citation J.NAT.PROD.,58,520(1995)
Literature Reference DOI 10.1021/np50118a006
Molecular Weight 318.713 g/mol
Solvent DMSO-D6
Source File Reference UWPR1424