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2-Benzoylimino-3-allyl-5-methyl-1,3,4-thiadiazolidine
SpectraBase Compound ID 3wFR0WYGQfR
InChI InChI=1S/C13H13N3OS/c1-3-9-16-13(18-10(2)15-16)14-12(17)11-7-5-4-6-8-11/h3-8H,1,9H2,2H3/b14-13-
InChIKey CPJQMQSAMHLYLF-YPKPFQOOSA-N
Mol Weight 259.33 g/mol
Molecular Formula C13H13N3OS
Exact Mass 259.077933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gsq0reiyDny
Name 2-Benzoylimino-3-allyl-5-methyl-1,3,4-thiadiazolidine
CAS Registry Number 78258-09-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13N3OS
InChI InChI=1S/C13H13N3OS/c1-3-9-16-13(18-10(2)15-16)14-12(17)11-7-5-4-6-8-11/h3-8H,1,9H2,2H3/b14-13-
InChIKey CPJQMQSAMHLYLF-YPKPFQOOSA-N
Instrument Name Bruker WH-90
Literature Reference D.M. Rackham, S.E. Morgan, Org. Magn. Resonance 14, 515 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3