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(2-phenyl-6,7-dihydro-5H-thiopyrano[3,2-c]pyrazol-3-yl) acetate
SpectraBase Compound ID CKPgEIBYHYm
InChI InChI=1S/C14H14N2O2S/c1-10(17)18-14-13-12(8-5-9-19-13)15-16(14)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3
InChIKey BYCAJRREBRJSRJ-UHFFFAOYSA-N
Mol Weight 274.34 g/mol
Molecular Formula C14H14N2O2S
Exact Mass 274.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44tU1XHUHWF
Name (2-phenyl-6,7-dihydro-5H-thiopyrano[3,2-c]pyrazol-3-yl) acetate
CAS Registry Number 124187-80-0
Comments Less than 3 mono-isotopic peaks
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Formula C14H14N2O2S
InChI InChI=1S/C14H14N2O2S/c1-10(17)18-14-13-12(8-5-9-19-13)15-16(14)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3
InChIKey BYCAJRREBRJSRJ-UHFFFAOYSA-N
Molecular Weight 274.338 g/mol
SMILES c1([n](nc2c1SCCC2)-c1ccccc1)OC(=O)C
SPLASH splash10-001i-0090000000-7f59f628fb70960d78bf
Source of Spectrum Y-26-187-17
Synonyms (2-phenyl-6,7-dihydro-5H-thiopyrano[3,2-c]pyrazol-3-yl) ethanoate acetic acid (2-phenyl-6,7-dihydro-5H-thiopyrano[3,2-c]pyrazol-3-yl) ester
Wiley ID 1277928