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3-((5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl) thio)-4-hydroxy-2H-chromen-2-one
SpectraBase Compound ID Ktk5h1p9f0y
InChI InChI=1S/C17H9ClN2O4S/c18-10-7-5-9(6-8-10)15-19-20-17(24-15)25-14-13(21)11-3-1-2-4-12(11)23-16(14)22/h1-8,21H
InChIKey XWPCMYLAVAWTEM-UHFFFAOYSA-N
Mol Weight 372.78 g/mol
Molecular Formula C17H9ClN2O4S
Exact Mass 371.997156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLrbV1fo2ZW
Name 3-((5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl) thio)-4-hydroxy-2H-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H9ClN2O4S
InChI InChI=1S/C17H9ClN2O4S/c18-10-7-5-9(6-8-10)15-19-20-17(24-15)25-14-13(21)11-3-1-2-4-12(11)23-16(14)22/h1-8,21H
InChIKey XWPCMYLAVAWTEM-UHFFFAOYSA-N
Instrument Name Agilent technologies HP 5937
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202200043
Molecular Weight 372.782 g/mol
SMILES OC1=C(Sc2nnc(-c3ccc(Cl)cc3)o2)C(Oc2c1cccc2)=O
SPLASH splash10-00fr-1901000000-6937b1c87b15944e3f1c
Source of Spectrum CBD-19-SM32-7e
Wiley ID 1880580