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Emodin

View entire compound with spectra: 18 NMR, 1 FTIR, and 9 MS (GC)

Emodin
SpectraBase Compound ID Ct3LL5ZeIpw
InChI InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
InChIKey RHMXXJGYXNZAPX-UHFFFAOYSA-N
Mol Weight 270.24 g/mol
Molecular Formula C15H10O5
Exact Mass 270.052823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HQBuOVn8Evr
Name EMODIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H10O5
InChI InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
InChIKey RHMXXJGYXNZAPX-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 270.241 g/mol
Solvent DMSO-D6
Source File Reference UWPR1422