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PHAEOCAULISIN_J
SpectraBase Compound ID Itw2zzQ8g2I
InChI InChI=1S/C12H18O3/c1-8-7-9(13)3-4-10-11(2,14)5-6-12(8,10)15/h7,10,14-15H,3-6H2,1-2H3/t10-,11+,12-/m1/s1
InChIKey ZRAWYUAGCGVSLC-GRYCIOLGSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BLYv7pgSJQy
Name PHAEOCAULISIN_J
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8-7-9(13)3-4-10-11(2,14)5-6-12(8,10)15/h7,10,14-15H,3-6H2,1-2H3/t10-,11+,12-/m1/s1
InChIKey ZRAWYUAGCGVSLC-GRYCIOLGSA-N
Literature Reference Author Y.LIU,J.H.MA,Q.ZHAO,C.R.LIAO,L.Q.DING,L.X.CHEN,F.ZHAO,F.QIU
Literature Reference Citation J.NAT.PROD.,76,1150(2013)
Literature Reference DOI 10.1021/np400202f
Molecular Weight 210.273 g/mol
Sample ID 42650
Solvent CDCl3