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Phenprocoumon

View entire compound with spectra: 1 NMR, 1 FTIR, and 8 MS (GC)

Phenprocoumon
SpectraBase Compound ID 3oDAAZJy7Ly
InChI InChI=1S/C18H16O3/c1-2-13(12-8-4-3-5-9-12)16-17(19)14-10-6-7-11-15(14)21-18(16)20/h3-11,13,19H,2H2,1H3
InChIKey DQDAYGNAKTZFIW-UHFFFAOYSA-N
Mol Weight 280.32 g/mol
Molecular Formula C18H16O3
Exact Mass 280.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JH0MgxRNQzg
Name Phenprocoumon
CAS Registry Number 5999-41-7
Comments BRUKER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H16O3
InChI InChI=1S/C18H16O3/c1-2-13(12-8-4-3-5-9-12)16-17(19)14-10-6-7-11-15(14)21-18(16)20/h3-11,13,19H,2H2,1H3
InChIKey DQDAYGNAKTZFIW-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference K. Chan, D. Giannini, Tetrahedron 33, 899 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6