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2-Acetamido-5-benzylthio-1,3,4-thiadiazole

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

2-Acetamido-5-benzylthio-1,3,4-thiadiazole
SpectraBase Compound ID CCLjykEXhSu
InChI InChI=1S/C11H11N3OS2/c1-8(15)12-10-13-14-11(17-10)16-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,12,13,15)
InChIKey CXGNGMANBKYIEF-UHFFFAOYSA-N
Mol Weight 265.35 g/mol
Molecular Formula C11H11N3OS2
Exact Mass 265.034354 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID InMkYhJkedd
Name 2-Acetamido-5-benzylthio-1,3,4-thiadiazole
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 211362
CAS Registry Number 64387-67-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N3OS2
InChI InChI=1S/C11H11N3OS2/c1-8(15)12-10-13-14-11(17-10)16-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,12,13,15)
InChIKey CXGNGMANBKYIEF-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_003010