| SpectraBase Compound ID | buxXV9jpJ9 |
|---|---|
| InChI | InChI=1S/C20H19NO4/c1-2-24-20(23)14-11-13(15-8-5-6-10-21-15)17-12-7-3-4-9-16(12)25-19(17)18(14)22/h3-10,13,17,19,22H,2,11H2,1H3/t13-,17-,19-/m1/s1 |
| InChIKey | LKKYZEGWIQKXNO-OMWUSAIZSA-N |
| Mol Weight | 337.38 g/mol |
| Molecular Formula | C20H19NO4 |
| Exact Mass | 337.131408 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7lS5jhYgcjN |
|---|---|
| Name | Ethyl (rac)-(1R,4aS,9bR)-1,2,4a,9b-tetrahydro-4-hydroxy-1-(2'-pyridyl)-dibenzofuran-3-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H19NO4 |
| InChI | InChI=1S/C20H19NO4/c1-2-24-20(23)14-11-13(15-8-5-6-10-21-15)17-12-7-3-4-9-16(12)25-19(17)18(14)22/h3-10,13,17,19,22H,2,11H2,1H3/t13-,17-,19-/m1/s1 |
| InChIKey | LKKYZEGWIQKXNO-OMWUSAIZSA-N |
| Molecular Weight | 337.375 g/mol |
| SMILES | OC=1[C@@]2(Oc3ccccc3[C@@]2([C@](CC1C(=O)OCC)(c1ncccc1)[H])[H])[H] |
| SPLASH | splash10-07mr-3293000000-e4ed59e9b1e2af1d677e |
| Source of Spectrum | F5-3-2301-11c |
| Synonyms | Ethyl (rac)-(1S,4aR,9bS)-1,2,4a,9b-tetrahydro-4-hydroxy-1-(2'-pyridyl)-dibenzofuran-3-carboxylate (1S,4aR,9bS)-ethyl 4-hydroxy-1-(pyridin-2-yl)-1,2,4a,9b-tetrahydrodibenzo[b,d]furan-3-carboxylate (1S,4aR,9bS)-4-hydroxy-1-(2-pyridinyl)-1,2,4a,9b-tetrahydrodibenzofuran-3-carboxylic acid ethyl ester Ethyl (1S,4aR,9bS)-4-hydroxy-1-pyridin-2-yl-1,2,4a,9b-tetrahydrodibenzofuran-3-carboxylate Ethyl (1S,4aR,9bS)-4-hydroxy-1-(2-pyridyl)-1,2,4a,9b-tetrahydrodibenzofuran-3-carboxylate Ethyl (1S,4aR,9bS)-4-oxidanyl-1-pyridin-2-yl-1,2,4a,9b-tetrahydrodibenzofuran-3-carboxylate |
| Wiley ID | 1732362 |