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1-(4-methyl-5-{2-[(3-methylphenyl)methyl]-1,3-thiazol-4-yl}-1,3-thiazol-2-yl)butan-2-one
SpectraBase Compound ID CZAcPWn1sCZ
InChI InChI=1S/C16H16N4O2S2/c1-3-13(22)20-16-17-9(2)14(24-16)12-8-23-15(19-12)18-10-5-4-6-11(21)7-10/h4-8,21H,3H2,1-2H3,(H,18,19)(H,17,20,22)
InChIKey SSKDIYUXTMPSAH-UHFFFAOYSA-N
Mol Weight 360.45 g/mol
Molecular Formula C16H16N4O2S2
Exact Mass 360.071468 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3wESvreQD3M
Name 1-(4-methyl-5-{2-[(3-methylphenyl)methyl]-1,3-thiazol-4-yl}-1,3-thiazol-2-yl)butan-2-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.071468117 u
Formula C16H16N4O2S2
InChI InChI=1S/C16H16N4O2S2/c1-3-13(22)20-16-17-9(2)14(24-16)12-8-23-15(19-12)18-10-5-4-6-11(21)7-10/h4-8,21H,3H2,1-2H3,(H,18,19)(H,17,20,22)
InChIKey SSKDIYUXTMPSAH-UHFFFAOYSA-N
Molecular Weight 360.450 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7258
Solvent DMSO-d6
Source Vendor ID: NMR/13307255; Lab Info: MIH; Lab Number: A2229/0093857