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3-PENTYL-ISOCHROMEN-1-ONE

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3-PENTYL-ISOCHROMEN-1-ONE
SpectraBase Compound ID LXyG0k5wBrz
InChI InChI=1S/C14H16O2/c1-2-3-4-8-12-10-11-7-5-6-9-13(11)14(15)16-12/h5-7,9-10H,2-4,8H2,1H3
InChIKey NRWIDUQJBDCLFR-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45cyiUm5wYp
Name 3-PENTYL-ISOCHROMEN-1-ONE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c1-2-3-4-8-12-10-11-7-5-6-9-13(11)14(15)16-12/h5-7,9-10H,2-4,8H2,1H3
InChIKey NRWIDUQJBDCLFR-UHFFFAOYSA-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 216.280 g/mol
Sample ID 3038
Solvent CDCl3