SpectraBase Compound ID | 4puxCjTSPiJ |
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InChI | InChI=1S/C5H3NO4S/c7-4(8)2-1-11-3(6-2)5(9)10/h1H,(H,7,8)(H,9,10) |
InChIKey | RUTJJFYMKNSTIA-UHFFFAOYSA-N |
Mol Weight | 173.14 g/mol |
Molecular Formula | C5H3NO4S |
Exact Mass | 172.978279 g/mol |
SpectraBase Spectrum ID | 3KvcHXa7XiW |
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Name | Thiazole-2,4-dicarboxylic acid |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C5H3NO4S |
InChI | InChI=1S/C5H3NO4S/c7-4(8)2-1-11-3(6-2)5(9)10/h1H,(H,7,8)(H,9,10) |
InChIKey | RUTJJFYMKNSTIA-UHFFFAOYSA-N |
Molecular Weight | 173.142 g/mol |
SMILES | OC(c1nc(C(=O)O)cs1)=O |
SPLASH | splash10-00di-0900000000-e22577ff4603c1f714ad |
Source of Spectrum | F-67-271-5c |
Wiley ID | 1685513 |