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3-Methylrhodanine
SpectraBase Compound ID A1KGC7EkcRK
InChI InChI=1S/C4H5NOS2/c1-5-3(6)2-8-4(5)7/h2H2,1H3
InChIKey JKLZCQWVERBDEZ-UHFFFAOYSA-N
Mol Weight 147.21 g/mol
Molecular Formula C4H5NOS2
Exact Mass 146.981256 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hz6WsKDo9Zn
Name 3-Methylrhodanine
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number M80458
CAS Registry Number 4807-55-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5NOS2
InChI InChI=1S/C4H5NOS2/c1-5-3(6)2-8-4(5)7/h2H2,1H3
InChIKey JKLZCQWVERBDEZ-UHFFFAOYSA-N
Observed nucleus 13C
Purity 96%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_012391