| SpectraBase Compound ID | H2bU0XOO7B7 |
|---|---|
| InChI | InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14?,15-/m1/s1 |
| InChIKey | BLUAFEHZUWYNDE-DCJAHCNHSA-N |
| Mol Weight | 282.34 g/mol |
| Molecular Formula | C15H22O5 |
| Exact Mass | 282.146724 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L0XRuc4EsS3 |
|---|---|
| Name | Qinghaosu |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H22O5 |
| InChI | InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14?,15-/m1/s1 |
| InChIKey | BLUAFEHZUWYNDE-DCJAHCNHSA-N |
| Molecular Weight | 282.336 g/mol |
| SMILES | [C@@]123[C@@]4(OC([C@@]([C@@]3(CC[C@]([C@@]1(CCC(OO2)(C)O4)[H])(C)[H])[H])(C)[H])=O)[H] |
| SPLASH | splash10-0006-6910000000-065f1ff456ef930c1706 |
| Source of Spectrum | CD-403-0-0 |
| Wiley ID | 1285776 |