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(S)-5-(Benzo[d][1,3]dioxol-5-yl)-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID 4YDFhrdX1DQ
InChI InChI=1S/C17H16N2O2/c1-12-9-15(19(18-12)14-5-3-2-4-6-14)13-7-8-16-17(10-13)21-11-20-16/h2-8,10,15H,9,11H2,1H3/t15-/m0/s1
InChIKey AVQCIFVFYWZMGT-HNNXBMFYSA-N
Mol Weight 280.33 g/mol
Molecular Formula C17H16N2O2
Exact Mass 280.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5z3neuCgNFC
Name (S)-5-(Benzo[d][1,3]dioxol-5-yl)-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazole
Comments Less than 3 mono-isotopic peaks
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Formula C17H16N2O2
InChI InChI=1S/C17H16N2O2/c1-12-9-15(19(18-12)14-5-3-2-4-6-14)13-7-8-16-17(10-13)21-11-20-16/h2-8,10,15H,9,11H2,1H3/t15-/m0/s1
InChIKey AVQCIFVFYWZMGT-HNNXBMFYSA-N
Molecular Weight 280.327 g/mol
SMILES C1(=NN([C@@](C1)(c1cc2OCOc2cc1)[H])c1ccccc1)C
SPLASH splash10-001i-0290000000-7403de2f6f1390d6b39f
Source of Spectrum F4-42-2175-2f
Wiley ID 1673946