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(+/-)-8-FLUORO-3-PENTYL-ISOCHROMAN-1-ONE;(RAC)-(3R)-8-FLUORO-3-PENTYL-3,4-DIHYDRO-1H-ISOCHROMEN-1-ONE
SpectraBase Compound ID 5lbRndFZWaN
InChI InChI=1S/C14H17FO2/c1-2-3-4-7-11-9-10-6-5-8-12(15)13(10)14(16)17-11/h5-6,8,11H,2-4,7,9H2,1H3/t11-/m1/s1
InChIKey LVZIBWIAVUFAQA-LLVKDONJSA-N
Mol Weight 236.29 g/mol
Molecular Formula C14H17FO2
Exact Mass 236.121258 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxDV7OTJCXW
Name (+/-)-8-FLUORO-3-PENTYL-ISOCHROMAN-1-ONE;(RAC)-(3R)-8-FLUORO-3-PENTYL-3,4-DIHYDRO-1H-ISOCHROMEN-1-ONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17FO2
InChI InChI=1S/C14H17FO2/c1-2-3-4-7-11-9-10-6-5-8-12(15)13(10)14(16)17-11/h5-6,8,11H,2-4,7,9H2,1H3/t11-/m1/s1
InChIKey LVZIBWIAVUFAQA-LLVKDONJSA-N
Literature Reference Author V.HAMPL,I.WETZEL,F.BRACHER,J.KRAUSS
Literature Reference Citation SCI.PHARM.,79,21(2011)
Literature Reference DOI 10.3797/scipharm.1011-10
Molecular Weight 236.286 g/mol
Sample ID 3042
Solvent CDCl3