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4-(4-Chlorophenyl)sulfanyl-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-indazole
SpectraBase Compound ID 1eansTysgiA
InChI InChI=1S/C22H16ClN3O3S2/c23-14-6-8-17(9-7-14)31-19-13-16(26(27)28)12-18-20(19)21(22-29-10-11-30-22)24-25(18)15-4-2-1-3-5-15/h1-9,12-13,22H,10-11H2
InChIKey IUBYSYQSFXMSDY-UHFFFAOYSA-N
Mol Weight 469.96 g/mol
Molecular Formula C22H16ClN3O3S2
Exact Mass 469.032161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64oQSPBMLN8
Name 4-(4-Chlorophenyl)sulfanyl-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-indazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16ClN3O3S2
InChI InChI=1S/C22H16ClN3O3S2/c23-14-6-8-17(9-7-14)31-19-13-16(26(27)28)12-18-20(19)21(22-29-10-11-30-22)24-25(18)15-4-2-1-3-5-15/h1-9,12-13,22H,10-11H2
InChIKey IUBYSYQSFXMSDY-UHFFFAOYSA-N
Molecular Weight 469.961 g/mol
SMILES c1(n[n](-c2ccccc2)c2c1c(cc(N(=O)=O)c2)Sc1ccc(cc1)Cl)C1SCCO1
SPLASH splash10-01ti-7951300000-1c6fc95a56b4166af8dc
Synonyms 4-[(4-chlorophenyl)thio]-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-indazole 4-[(4-chlorophenyl)thio]-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenylindazole
Wiley ID 1464162