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CRM-51006;1-(3'-ETHYL-2',4'-DIHYDROXYPHENYL)-2-METHYL-1-HEXANONE
SpectraBase Compound ID 7Qnf9jLrwKr
InChI InChI=1S/C15H22O3/c1-4-6-7-10(3)14(17)12-8-9-13(16)11(5-2)15(12)18/h8-10,16,18H,4-7H2,1-3H3
InChIKey PLVKWJZWAJSIOE-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BY25TN1GoRu
Name CRM-51006;1-(3'-ETHYL-2',4'-DIHYDROXYPHENYL)-2-METHYL-1-HEXANONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-4-6-7-10(3)14(17)12-8-9-13(16)11(5-2)15(12)18/h8-10,16,18H,4-7H2,1-3H3
InChIKey PLVKWJZWAJSIOE-UHFFFAOYSA-N
Literature Reference Author W.K.OH,H.OH,B.Y.KIM,B.S.KIM,J.S.AHN
Literature Reference Citation J.ANTIBIOTICS,57,808(2004)
Literature Reference DOI 10.7164/antibiotics.57.808
Molecular Weight 250.338 g/mol
Sample ID 65819
Solvent CD3OD