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(5S*,6R*) -5-Hydroxy-3-methyl-1-phenyl-6-(thiophen-2-yl)-5,6-dihydropyrano[2,3-c]pyrazol-4(1H)-one
SpectraBase Compound ID 3jUKg9QZ9cu
InChI InChI=1S/C17H14N2O3S/c1-10-13-14(20)15(21)16(12-8-5-9-23-12)22-17(13)19(18-10)11-6-3-2-4-7-11/h2-9,15-16,21H,1H3/t15-,16+/m1/s1
InChIKey PXDKCIFZZQMFPE-CVEARBPZSA-N
Mol Weight 326.37 g/mol
Molecular Formula C17H14N2O3S
Exact Mass 326.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8NtaV53SHX
Name (5S*,6R*) -5-Hydroxy-3-methyl-1-phenyl-6-(thiophen-2-yl)-5,6-dihydropyrano[2,3-c]pyrazol-4(1H)-one
Alternate Name(s) (5S*,6R*)-5-Hydroxy-3-methyl-1-phenyl-6-(thiophen-2-yl)-5,6-dihydropyrano[2,3-c]pyrazol-4(1H)-one (5S,6R)-5-hydroxy-3-methyl-1-phenyl-6-(thiophen-2-yl)-5,6-dihydropyrano[2,3-c]pyrazol-4(1H)-one
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Formula C17H14N2O3S
InChI InChI=1S/C17H14N2O3S/c1-10-13-14(20)15(21)16(12-8-5-9-23-12)22-17(13)19(18-10)11-6-3-2-4-7-11/h2-9,15-16,21H,1H3/t15-,16+/m1/s1
InChIKey PXDKCIFZZQMFPE-CVEARBPZSA-N
Molecular Weight 326.370 g/mol
SMILES O[C@]1([C@@](Oc2c(C1=O)c(C)n[n]2-c1ccccc1)(c1sccc1)[H])[H]
SPLASH splash10-0udl-8391000000-c32a3f8108c7efaee918
Source of Spectrum Y-51-131-3h
Wiley ID 1741215