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OWRBHIFRTYOIFK-JHYUDYDFSA-N
SpectraBase Compound ID 5Na3sQKLGFy
InChI InChI=1S/C7H12O4/c1-11-7-3-5(9)4(8)2-6(7)10/h4,6-8,10H,2-3H2,1H3/t4-,6+,7-/m0/s1
InChIKey OWRBHIFRTYOIFK-JHYUDYDFSA-N
Mol Weight 160.17 g/mol
Molecular Formula C7H12O4
Exact Mass 160.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJEvIneCj0W
Name OWRBHIFRTYOIFK-JHYUDYDFSA-N
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O4
InChI InChI=1S/C7H12O4/c1-11-7-3-5(9)4(8)2-6(7)10/h4,6-8,10H,2-3H2,1H3/t4-,6+,7-/m0/s1
InChIKey OWRBHIFRTYOIFK-JHYUDYDFSA-N
Literature Reference Author A.EVIDENTE,L.MADAU,B.SCANU,A.ANDOLFI,M.MASI,A.MOTTA,A.TUZI
Literature Reference Citation J.NAT.PROD.,74,757(2011)
Literature Reference DOI 10.1021/np100837r
Molecular Weight 160.170 g/mol
Sample ID 37295
Solvent CDCl3