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2-methyl-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]butanamide
SpectraBase Compound ID H8Gk2nSbBgc
InChI InChI=1S/C13H16N2O3S2/c1-4-8(2)12(16)15-13-14-10-6-5-9(20(3,17)18)7-11(10)19-13/h5-8H,4H2,1-3H3,(H,14,15,16)
InChIKey CAHDAIQLPLVTBB-UHFFFAOYSA-N
Mol Weight 312.4 g/mol
Molecular Formula C13H16N2O3S2
Exact Mass 312.060235 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1DZPF0q5AcD
Name 2-methyl-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]butanamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H16N2O3S2/c1-4-8(2)12(16)15-13-14-10-6-5-9(20(3,17)18)7-11(10)19-13/h5-8H,4H2,1-3H3,(H,14,15,16)
InChIKey CAHDAIQLPLVTBB-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15384
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: C34341; Labnumber: SERK1-22199; SBI_ID: SBI-015387
Temperature 306 °C