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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWbImAr6TXe
Name PHENPROCOUMON
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 GC
Molecular Weight 280.323 g/mol
SMILES OC1=C(C(c2ccccc2)CC)C(=O)Oc2ccccc12
SPLASH splash10-0udi-3950000000-5b757fdef1457e5c2257
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany