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N-(4-Chlorophenyl)-6-methoxycoumarin-3-carboxamide
SpectraBase Compound ID CKXshZYeRlx
InChI InChI=1S/C17H12ClNO4/c1-22-13-6-7-15-10(8-13)9-14(17(21)23-15)16(20)19-12-4-2-11(18)3-5-12/h2-9H,1H3,(H,19,20)
InChIKey DUVYZLKIWPLPKD-UHFFFAOYSA-N
Mol Weight 329.74 g/mol
Molecular Formula C17H12ClNO4
Exact Mass 329.045486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNSQYlCoseE
Name N-(4-Chlorophenyl)-6-methoxycoumarin-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClNO4
InChI InChI=1S/C17H12ClNO4/c1-22-13-6-7-15-10(8-13)9-14(17(21)23-15)16(20)19-12-4-2-11(18)3-5-12/h2-9H,1H3,(H,19,20)
InChIKey DUVYZLKIWPLPKD-UHFFFAOYSA-N
Instrument Name Hewlett- Packard-5972-MSD
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.7b00918
Molecular Weight 329.739 g/mol
SMILES N(C(C=1C(Oc2c(cc(cc2)OC)C1)=O)=O)c1ccc(cc1)Cl
SPLASH splash10-0v03-0291000000-18ffaf74b27e74f7a4d4
Source of Spectrum AF-60-SM5-20a
Wiley ID 1870142