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ACENOCOUMAROL-ARTIFACT 3
SpectraBase Compound ID hRnvtQyNJJ
InChI InChI=1S/C19H13NO5/c1-11-10-15(12-6-8-13(9-7-12)20(22)23)17-18(24-11)14-4-2-3-5-16(14)25-19(17)21/h2-10,15H,1H3
InChIKey ZNFIEMFBCICTAA-UHFFFAOYSA-N
Mol Weight 335.32 g/mol
Molecular Formula C19H13NO5
Exact Mass 335.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBUvshCY9Zi
Name ACENOCOUMAROL-ARTIFACT 3
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C19H13NO5
InChI InChI=1S/C19H13NO5/c1-11-10-15(12-6-8-13(9-7-12)20(22)23)17-18(24-11)14-4-2-3-5-16(14)25-19(17)21/h2-10,15H,1H3
InChIKey ZNFIEMFBCICTAA-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 335.315 g/mol
SMILES c1cc2C=3OC(C)=CC(c4ccc(N(=O)=O)cc4)C3C(=O)Oc2cc1
SPLASH splash10-03di-4491000000-d82f2e2a8ca86db5343b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany