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IIIFVUMJBALUGH-NMTNZHRMSA-N
SpectraBase Compound ID 9ljCDgvQR9E
InChI InChI=1S/C10H13ClO4/c1-6-10(14)8(11)4-2-7(12)3-5-9(13)15-6/h2-8,10,12,14H,1H3/b4-2+,5-3-/t6-,7-,8?,10+/m1/s1
InChIKey IIIFVUMJBALUGH-NMTNZHRMSA-N
Mol Weight 232.66 g/mol
Molecular Formula C10H13ClO4
Exact Mass 232.050237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KlrSXNnHMvT
Name IIIFVUMJBALUGH-NMTNZHRMSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13ClO4
InChI InChI=1S/C10H13ClO4/c1-6-10(14)8(11)4-2-7(12)3-5-9(13)15-6/h2-8,10,12,14H,1H3/b4-2+,5-3-/t6-,7-,8?,10+/m1/s1
InChIKey IIIFVUMJBALUGH-NMTNZHRMSA-N
Literature Reference Author H.GREVE,P.J.SCHUPP,E.EGUEREVA,S.KEHRAUS,G.M.KOENIG
Literature Reference Citation J.NAT.PROD.,71,1651(2008)
Literature Reference DOI 10.1021/np8003326
Molecular Weight 232.664 g/mol
Sample ID 29093
Solvent ACETONE-D6