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Acenocoumarol breakdown (191)
SpectraBase Compound ID 6iGM3Kwdw7g
InChI InChI=1S/C19H15NO6/c1-11(21)10-15(12-6-8-13(9-7-12)20(24)25)17-18(22)14-4-2-3-5-16(14)26-19(17)23/h2-9,15,22H,10H2,1H3
InChIKey VABCILAOYCMVPS-UHFFFAOYSA-N
Mol Weight 353.33 g/mol
Molecular Formula C19H15NO6
Exact Mass 353.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkmktIga1os
Name ACENOCOUMAROL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H15NO6
InChI InChI=1S/C19H15NO6/c1-11(21)10-15(12-6-8-13(9-7-12)20(24)25)17-18(22)14-4-2-3-5-16(14)26-19(17)23/h2-9,15,22H,10H2,1H3
InChIKey VABCILAOYCMVPS-UHFFFAOYSA-N
Instrument Name DI
Molecular Weight 353.330 g/mol
SMILES OC=1c2ccccc2OC(=O)C1C(CC(C)=O)c1ccc(N(=O)=O)cc1
SPLASH splash10-03kc-9735000000-a474feeb28db4e9dd0cc
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany