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(3R,4R)-4-(BENZOTHAIZOL-2'-YL-DITHIO)-3-PHENOXYACETAMIDO-AZEDITIN-2-ONE;KAMIYA-COMPOUND
SpectraBase Compound ID LulhNj3nk6j
InChI InChI=1S/C18H15N3O3S3/c22-14(10-24-11-6-2-1-3-7-11)20-15-16(23)21-17(15)26-27-18-19-12-8-4-5-9-13(12)25-18/h1-9,15,17H,10H2,(H,20,22)(H,21,23)
InChIKey KHJREHLBWINTQY-UHFFFAOYSA-N
Mol Weight 417.52 g/mol
Molecular Formula C18H15N3O3S3
Exact Mass 417.027555 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HD1SX6o5J17
Name (3R,4R)-4-(Benzothaizol-2'-yl-dithio)-3-phenoxyacetamido-azeditin-2-one
CAS Registry Number 73395-53-6
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H15N3O3S3
InChI InChI=1S/C18H15N3O3S3/c22-14(10-24-11-6-2-1-3-7-11)20-15-16(23)21-17(15)26-27-18-19-12-8-4-5-9-13(12)25-18/h1-9,15,17H,10H2,(H,20,22)(H,21,23)
InChIKey KHJREHLBWINTQY-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference Austr. J. Chem. 40, 223 (1987).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3/DMSO-D6