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5-Chloro-6'-(4-fluorophenyl)-2'-thioxo-2',3'-dihydro-1???Hspiro[indole-3,4'-pyrimidin]-2(1H)-one
SpectraBase Compound ID w8RKanQFiS
InChI InChI=1S/C17H11ClFN3OS/c18-10-3-6-13-12(7-10)17(15(23)20-13)8-14(21-16(24)22-17)9-1-4-11(19)5-2-9/h1-8H,(H,20,23)(H2,21,22,24)
InChIKey JQVMBZLAAUJJOK-UHFFFAOYSA-N
Mol Weight 359.81 g/mol
Molecular Formula C17H11ClFN3OS
Exact Mass 359.029539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20cgCe6MIqR
Name 5-Chloro-6'-(4-fluorophenyl)-2'-thioxo-2',3'-dihydro-1???Hspiro[indole-3,4'-pyrimidin]-2(1H)-one
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11ClFN3OS
InChI InChI=1S/C17H11ClFN3OS/c18-10-3-6-13-12(7-10)17(15(23)20-13)8-14(21-16(24)22-17)9-1-4-11(19)5-2-9/h1-8H,(H,20,23)(H2,21,22,24)
InChIKey JQVMBZLAAUJJOK-UHFFFAOYSA-N
Instrument Name Finnigan-MAT-8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3021
Molecular Weight 359.806 g/mol
SMILES N1C(C2(c3cc(ccc13)Cl)C=C(NC(N2)=S)c1ccc(cc1)F)=O
SPLASH splash10-052r-4962000000-6365ed51440fc68e047e
Source of Spectrum Y-55-SM22-4j
Wiley ID 1878743