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N-(5-Methyl-3-[2-propynyl]-1,3,4-thiadiazol-2(3H)-ylidene)-benzamide
SpectraBase Compound ID 1VemDm9ubQ8
InChI InChI=1S/C13H11N3OS/c1-3-9-16-13(18-10(2)15-16)14-12(17)11-7-5-4-6-8-11/h1,4-8H,9H2,2H3/b14-13-
InChIKey NDJWXKOJAYMWMY-YPKPFQOOSA-N
Mol Weight 257.31 g/mol
Molecular Formula C13H11N3OS
Exact Mass 257.062283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CeoHT8Bmtbo
Name N-(5-Methyl-3-[2-propynyl]-1,3,4-thiadiazol-2(3H)-ylidene)-benzamide
CAS Registry Number 103811-55-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H11N3OS
InChI InChI=1S/C13H11N3OS/c1-3-9-16-13(18-10(2)15-16)14-12(17)11-7-5-4-6-8-11/h1,4-8H,9H2,2H3/b14-13-
InChIKey NDJWXKOJAYMWMY-YPKPFQOOSA-N
Instrument Name Varian FT-80
Literature Reference S.R. Salman, Z. Muhi-Eldeen, A.H.Yasin, Magn. Res. Chem. 24, 271 (1986).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3