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2-AMINO-4-BENZOYL-5,5-PENTAMETHYLEN-4,5-DIHYDRO-1,3,4-THIADIAZOLE

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2-AMINO-4-BENZOYL-5,5-PENTAMETHYLEN-4,5-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID 7vVcPpROklS
InChI InChI=1S/C14H17N3OS/c15-13-16-17(12(18)11-7-3-1-4-8-11)14(19-13)9-5-2-6-10-14/h1,3-4,7-8H,2,5-6,9-10H2,(H2,15,16)
InChIKey JSNGAFZPCPEASA-UHFFFAOYSA-N
Mol Weight 275.37 g/mol
Molecular Formula C14H17N3OS
Exact Mass 275.109233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IwJQ9KEd73g
Name 4-Benzoyl-5,5-pentamethylene-4,5-dihydro-1,3,4-thiadiazole-2-amine
CAS Registry Number 107261-74-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H17N3OS
InChI InChI=1S/C14H17N3OS/c15-13-16-17(12(18)11-7-3-1-4-8-11)14(19-13)9-5-2-6-10-14/h1,3-4,7-8H,2,5-6,9-10H2,(H2,15,16)
InChIKey JSNGAFZPCPEASA-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference S. Andreae, E. Schmitz, H. Seeboth, J. Prakt. Chem. 328, 205 (1986).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6