SpectraBase Compound ID | OihDmMTloH |
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InChI | InChI=1S/C5H8O4.2Na/c6-4(7)2-1-3-5(8)9;;/h1-3H2,(H,6,7)(H,8,9);;/q;2*+1/p-2 |
InChIKey | ZUDYLZOBWIAUPC-UHFFFAOYSA-L |
Mol Weight | 176.07853856 g/mol |
Molecular Formula | C5H6Na2O4 |
Exact Mass | 176.006147 g/mol |
SpectraBase Spectrum ID | 57WeDBpmH8K |
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Name | Glutaric acid, disodium salt |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 176.006147229 u |
Formula | C5H6Na2O4 |
InChI | InChI=1S/C5H8O4.2Na/c6-4(7)2-1-3-5(8)9;;/h1-3H2,(H,6,7)(H,8,9);;/q;2*+1/p-2 |
InChIKey | ZUDYLZOBWIAUPC-UHFFFAOYSA-L |
Molecular Weight | 176.079 g/mol |
SMILES | [Na+].C(C([O-])=O)CCC([O-])=O.[Na+] |
Spectrum/Structure Validation Score (Raman) | 0.957433 |