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Warfarin 4-methyl ether

View entire compound with spectra: 4 NMR, and 2 MS (GC)

Warfarin 4-methyl ether
SpectraBase Compound ID HpnNLWeM9q2
InChI InChI=1S/C20H18O4/c1-13(21)12-16(14-8-4-3-5-9-14)18-19(23-2)15-10-6-7-11-17(15)24-20(18)22/h3-11,16H,12H2,1-2H3
InChIKey FGAWENWBTHQLEE-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C20H18O4
Exact Mass 322.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4MStW9POSTd
Name Warfarin 4-methyl ether
CAS Registry Number 83306-74-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H18O4
InChI InChI=1S/C20H18O4/c1-13(21)12-16(14-8-4-3-5-9-14)18-19(23-2)15-10-6-7-11-17(15)24-20(18)22/h3-11,16H,12H2,1-2H3
InChIKey FGAWENWBTHQLEE-UHFFFAOYSA-N
Literature Reference H. Duddeck, M. Kaiser, Org. Magn. Resonance 20, 55 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3