SpectraBase Compound ID | 5fG9yRVrvhU |
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InChI | InChI=1S/C14H18O6/c1-4-19-12(15)8-9-13(16)20-14-10(17-2)6-5-7-11(14)18-3/h5-7H,4,8-9H2,1-3H3 |
InChIKey | QSZSDKQMIPMKNQ-UHFFFAOYSA-N |
Mol Weight | 282.29 g/mol |
Molecular Formula | C14H18O6 |
Exact Mass | 282.110338 g/mol |
SpectraBase Spectrum ID | IXSsmTvCRlx |
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Name | Succinic acid, 2,6-dimethoxyphenyl ethyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 282.110338294 u |
Formula | C14H18O6 |
InChI | InChI=1S/C14H18O6/c1-4-19-12(15)8-9-13(16)20-14-10(17-2)6-5-7-11(14)18-3/h5-7H,4,8-9H2,1-3H3 |
InChIKey | QSZSDKQMIPMKNQ-UHFFFAOYSA-N |
SMILES | C(C(OC1=C(C=CC=C1OC)OC)=O)CC(OCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.866951 |