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5-Benzoylimino-3,3-pentamethylen-1,2,4-thiadiazolidine
SpectraBase Compound ID 4DntojYcAT
InChI InChI=1S/C14H17N3OS/c18-12(11-7-3-1-4-8-11)15-13-16-14(17-19-13)9-5-2-6-10-14/h1,3-4,7-8,17H,2,5-6,9-10H2,(H,15,16,18)
InChIKey UYBRBIFHDFCTHH-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 2r9ESXEPbUn
Name 5-Benzoylimino-3,3-pentamethylene-1,2,4-thiadiazolidine
CAS Registry Number 117840-40-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H17N3OS
InChI InChI=1S/C14H17N3OS/c18-12(11-7-3-1-4-8-11)15-13-16-14(17-19-13)9-5-2-6-10-14/h1,3-4,7-8,17H,2,5-6,9-10H2,(H,15,16,18)
InChIKey UYBRBIFHDFCTHH-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference S. Andreae, E. Schmitz, J. Prakt. Chem. 329, 1008 (1987).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6