SpectraBase Compound ID | Ht444D0CFbY |
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InChI | InChI=1S/C8H14O5/c1-11-7(9)3-5-13-6-4-8(10)12-2/h3-6H2,1-2H3 |
InChIKey | AWPJXZZZMCWJGN-UHFFFAOYSA-N |
Mol Weight | 190.19 g/mol |
Molecular Formula | C8H14O5 |
Exact Mass | 190.084124 g/mol |
SpectraBase Spectrum ID | 4sOlXGMLI4E |
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Name | Dimethyl 3,3'-oxydipropanoate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 190.084123546 u |
Formula | C8H14O5 |
InChI | InChI=1S/C8H14O5/c1-11-7(9)3-5-13-6-4-8(10)12-2/h3-6H2,1-2H3 |
InChIKey | AWPJXZZZMCWJGN-UHFFFAOYSA-N |
Molecular Weight | 190.195 g/mol |
SMILES | C(C(OC)=O)COCCC(OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963326 |