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Warfarin

View entire compound with spectra: 3 NMR, 5 FTIR, and 22 MS (GC)

Warfarin
SpectraBase Compound ID FZOP0eTsWVs
InChI InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3
InChIKey PJVWKTKQMONHTI-UHFFFAOYSA-N
Mol Weight 308.33 g/mol
Molecular Formula C19H16O4
Exact Mass 308.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9DVeSxBRVq
Name WARFARIN
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H16O4
InChI InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3
InChIKey PJVWKTKQMONHTI-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 308.333 g/mol
SMILES OC1=C(C(c2ccccc2)CC(C)=O)C(=O)Oc2ccccc12
SPLASH splash10-014i-4981000000-0be8e9fd6d2379a322c6
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany