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thiazole, 2-(4,5-dihydro-3,5-diphenyl-1H-pyrazol-1-yl)-4-methyl-
SpectraBase Compound ID BkSnW9bttAR
InChI InChI=1S/C19H17N3S/c1-14-13-23-19(20-14)22-18(16-10-6-3-7-11-16)12-17(21-22)15-8-4-2-5-9-15/h2-11,13,18H,12H2,1H3
InChIKey IGNNWJOXMQCTKH-UHFFFAOYSA-N
Mol Weight 319.43 g/mol
Molecular Formula C19H17N3S
Exact Mass 319.114319 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Izs4nw13be3
Name Thiazole, 2-(4,5-dihydro-3,5-diphenyl-1H-pyrazol-1-yl)-4-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.114318733 u
Formula C19H17N3S
InChI InChI=1S/C19H17N3S/c1-14-13-23-19(20-14)22-18(16-10-6-3-7-11-16)12-17(21-22)15-8-4-2-5-9-15/h2-11,13,18H,12H2,1H3
InChIKey IGNNWJOXMQCTKH-UHFFFAOYSA-N
Molecular Weight 319.426 g/mol
SMILES C1=CC=C(C2=NN(C3=NC(C)=CS3)C(C2)C=2C=CC=CC2)C=C1