SpectraBase Compound ID | 3Htz5juK95O |
---|---|
InChI | InChI=1S/C7H14O2.C2H4O2/c1-4-6-5-8-7(2,3)9-6;1-2(3)4/h6H,4-5H2,1-3H3;1H3,(H,3,4) |
InChIKey | KLNOQYYWBMKNIX-UHFFFAOYSA-N |
Mol Weight | 190.24 g/mol |
Molecular Formula | C9H18O4 |
Exact Mass | 190.120509 g/mol |
SpectraBase Spectrum ID | FUumUVYq2Qz |
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Name | Ethyl dimethyl dioxolane acetate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 190.120509056 u |
Formula | C9H18O4 |
InChI | InChI=1S/C7H14O2.C2H4O2/c1-4-6-5-8-7(2,3)9-6;1-2(3)4/h6H,4-5H2,1-3H3;1H3,(H,3,4) |
InChIKey | KLNOQYYWBMKNIX-UHFFFAOYSA-N |
Molecular Weight | 190.239 g/mol |
SMILES | C(C)(=O)O.C1(OCC(O1)CC)(C)C |
Spectrum/Structure Validation Score (Raman) | 0.977036 |