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1-(4-Chloro-phenyl)-3-(5-methyl-2-furyl)-2-propen-1-one
SpectraBase Compound ID 3I2L4t9NAY3
InChI InChI=1S/C14H11ClO2/c1-10-2-7-13(17-10)8-9-14(16)11-3-5-12(15)6-4-11/h2-9H,1H3/b9-8+
InChIKey ZRRSPUXOCWAQRT-CMDGGOBGSA-N
Mol Weight 246.69 g/mol
Molecular Formula C14H11ClO2
Exact Mass 246.044757 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kz5MJo2WTFU
Name 1-(4-Chloro-phenyl)-3-(5-methyl-2-furyl)-2-propen-1-one
CAS Registry Number 76102-12-0
Comments REASSIGNED SHIFTS FROM MUSUMARRA
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H11ClO2
InChI InChI=1S/C14H11ClO2/c1-10-2-7-13(17-10)8-9-14(16)11-3-5-12(15)6-4-11/h2-9H,1H3/b9-8+
InChIKey ZRRSPUXOCWAQRT-CMDGGOBGSA-N
Instrument Name Jeol FX-100
Literature Reference G. Musumarra, S. Wold, S. Gronowitz, Org. Magn. Resonance 17, 118 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3