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N-(4-Mercaptophenyl)-4-oxo-4H-chromene-3-carboxamide
SpectraBase Compound ID 3BejyaFiTx7
InChI InChI=1S/C16H11NO3S/c18-15-12-3-1-2-4-14(12)20-9-13(15)16(19)17-10-5-7-11(21)8-6-10/h1-9,21H,(H,17,19)
InChIKey APLHCZXTJFULOU-UHFFFAOYSA-N
Mol Weight 297.33 g/mol
Molecular Formula C16H11NO3S
Exact Mass 297.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DAgVOTWP6Yw
Name N-(4-Mercaptophenyl)-4-oxo-4H-chromene-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11NO3S
InChI InChI=1S/C16H11NO3S/c18-15-12-3-1-2-4-14(12)20-9-13(15)16(19)17-10-5-7-11(21)8-6-10/h1-9,21H,(H,17,19)
InChIKey APLHCZXTJFULOU-UHFFFAOYSA-N
Instrument Name VG AutoSpec
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.6b00527
Molecular Weight 297.328 g/mol
SMILES N(C(C1=COc2ccccc2C1=O)=O)c1ccc(cc1)S
SPLASH splash10-00dj-0950000000-c8f0c4206eb0226b9679
Source of Spectrum AF-59-5888-9
Wiley ID 1848858