| SpectraBase Compound ID | 6RgWOPBRLJS |
|---|---|
| InChI | InChI=1S/C20H29NO7/c1-10(5-17-21-7-14(8-22)27-17)4-15-19(25)18(24)13(9-26-15)6-16-20(28-16)11(2)12(3)23/h5,7-8,11-13,15-16,18-20,23-25H,4,6,9H2,1-3H3/b10-5+/t11-,12-,13-,15?,16-,18+,19-,20-/m0/s1 |
| InChIKey | CDYVZAKSPBTUJG-HRFRBITJSA-N |
| Mol Weight | 395.45 g/mol |
| Molecular Formula | C20H29NO7 |
| Exact Mass | 395.194402 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6MVPzKvfTS5 |
|---|---|
| Name | 5-(Formyl)-2-(1-normon-2-yl)oxazole |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H29NO7 |
| InChI | InChI=1S/C20H29NO7/c1-10(5-17-21-7-14(8-22)27-17)4-15-19(25)18(24)13(9-26-15)6-16-20(28-16)11(2)12(3)23/h5,7-8,11-13,15-16,18-20,23-25H,4,6,9H2,1-3H3/b10-5+/t11-,12-,13-,15?,16-,18+,19-,20-/m0/s1 |
| InChIKey | CDYVZAKSPBTUJG-HRFRBITJSA-N |
| Molecular Weight | 395.452 g/mol |
| SMILES | O[C@]([C@@]([C@@]1(O[C@]1(C[C@]1(COC([C@@]([C@@]1(O)[H])(O)[H])C\C(=C\c1ncc(o1)C=O)C)[H])[H])[H])(C)[H])(C)[H] |
| SPLASH | splash10-0udi-0900000000-1d6e2b4404a04fb9d9c0 |
| Source of Spectrum | E1-39-452-2 |
| Wiley ID | 1598685 |