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1H-indazole, 4-[(2-furanylmethyl)thio]-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-
SpectraBase Compound ID 43vLJf0tCf2
InChI InChI=1S/C21H17N3O4S2/c25-24(26)15-11-17-19(18(12-15)30-13-16-7-4-8-27-16)20(21-28-9-10-29-21)22-23(17)14-5-2-1-3-6-14/h1-8,11-12,21H,9-10,13H2
InChIKey YNBDPEPSMBFDGC-UHFFFAOYSA-N
Mol Weight 439.5 g/mol
Molecular Formula C21H17N3O4S2
Exact Mass 439.066048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bxr0nCbWSZ1
Name 4-(2-furanylmethylthio)-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenylindazole
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Formula C21H17N3O4S2
InChI InChI=1S/C21H17N3O4S2/c25-24(26)15-11-17-19(18(12-15)30-13-16-7-4-8-27-16)20(21-28-9-10-29-21)22-23(17)14-5-2-1-3-6-14/h1-8,11-12,21H,9-10,13H2
InChIKey YNBDPEPSMBFDGC-UHFFFAOYSA-N
Molecular Weight 439.504 g/mol
SMILES c1(n[n](-c2ccccc2)c2c1c(cc(N(=O)=O)c2)SCc1occc1)C1SCCO1
SPLASH splash10-001i-9111000000-dc349274c530378074d3
Synonyms 4-(2-furfurylthio)-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-indazole 4-(2-furylmethylsulfanyl)-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-indazole 4-(furan-2-ylmethylsulfanyl)-6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-indazole
Wiley ID 1464161