| SpectraBase Compound ID | Gi84vfLcGfM |
|---|---|
| InChI | InChI=1S/C22H24O7/c23-17-4-1-3-14(10-17)9-16-13-29-22(27)18(16)11-15-6-7-20(19(24)12-15)28-8-2-5-21(25)26/h1,3-4,6-7,10,12,16,18,23-24H,2,5,8-9,11,13H2,(H,25,26)/t16-,18+/m0/s1 |
| InChIKey | KXAXNCMHCCUJDG-FUHWJXTLSA-N |
| Mol Weight | 400.43 g/mol |
| Molecular Formula | C22H24O7 |
| Exact Mass | 400.152203 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2PORLISkwYf |
|---|---|
| Name | (+-)-2-(3-Hydroxy-4-carbooxypropyloxybenzyl)-3-(3'-hydroxybenzyl)butyrolactone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H24O7 |
| InChI | InChI=1S/C22H24O7/c23-17-4-1-3-14(10-17)9-16-13-29-22(27)18(16)11-15-6-7-20(19(24)12-15)28-8-2-5-21(25)26/h1,3-4,6-7,10,12,16,18,23-24H,2,5,8-9,11,13H2,(H,25,26)/t16-,18+/m0/s1 |
| InChIKey | KXAXNCMHCCUJDG-FUHWJXTLSA-N |
| Molecular Weight | 400.427 g/mol |
| SMILES | Oc1cc(C[C@]2(COC([C@@]2(Cc2cc(c(cc2)OCCCC(=O)O)O)[H])=O)[H])ccc1 |
| SPLASH | splash10-00di-0902200000-522940200dfcec0e3c11 |
| Source of Spectrum | F-56-1880-7 |
| Wiley ID | 856300 |