SpectraBase Compound ID | 2ZSQlgNB6vz |
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InChI | InChI=1S/C13H16O6/c1-18-12-6-9(2-4-11(12)16)3-5-13(17)19-8-10(15)7-14/h2-6,10,14-16H,7-8H2,1H3/b5-3+ |
InChIKey | QXRAHTFDPBQKIM-HWKANZROSA-N |
Mol Weight | 268.26 g/mol |
Molecular Formula | C13H16O6 |
Exact Mass | 268.094688 g/mol |
SpectraBase Spectrum ID | 3gIMI6IaKeB |
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Name | Glyceryl ferulate |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 268.094688229 u |
Formula | C13H16O6 |
InChI | InChI=1S/C13H16O6/c1-18-12-6-9(2-4-11(12)16)3-5-13(17)19-8-10(15)7-14/h2-6,10,14-16H,7-8H2,1H3/b5-3+ |
InChIKey | QXRAHTFDPBQKIM-HWKANZROSA-N |
SMILES | C1=C(C=CC(=C1OC)O)\C=C\C(=O)OCC(O)CO |