SpectraBase Compound ID | GsvrXz6RDuy |
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InChI | InChI=1S/C9H10N2O3S/c10-8(12)5-11-3-1-7(2-4-11)15-6-9(13)14/h1-4H,5-6H2,(H2-,10,12,13,14)/p+1 |
InChIKey | WJZHGCPDSSIHKD-UHFFFAOYSA-O |
Mol Weight | 227.26 g/mol |
Molecular Formula | C9H11N2O3S |
Exact Mass | 227.049038 g/mol |
SpectraBase Spectrum ID | Kt8S23vfYC9 |
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Name | 1-carbamoylmethyl-4-carboxymethylthiopyridinium |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C9H11N2O3S |
InChI | InChI=1S/C9H10N2O3S/c10-8(12)5-11-3-1-7(2-4-11)15-6-9(13)14/h1-4H,5-6H2,(H2-,10,12,13,14)/p+1 |
InChIKey | WJZHGCPDSSIHKD-UHFFFAOYSA-O |
Instrument Name | Bruker AM-300 |
NMR Standard | DMSO-d5 1H |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | DMSO-d6 |