| SpectraBase Compound ID | 291maE0cVGu |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-6-4-11(17)13-8(3)15(18)19-14(13)12-7(2)10(16)5-9(6)12/h7-9,11-14,17H,1,4-5H2,2-3H3/t7-,8+,9+,11+,12+,13-,14-/m1/s1 |
| InChIKey | ZAPNUFCAIXITRW-LUQFHCQZSA-N |
| Mol Weight | 264.32 g/mol |
| Molecular Formula | C15H20O4 |
| Exact Mass | 264.136159 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1ABh4FulMFB |
|---|---|
| Name | Isoamberboin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-6-4-11(17)13-8(3)15(18)19-14(13)12-7(2)10(16)5-9(6)12/h7-9,11-14,17H,1,4-5H2,2-3H3/t7-,8+,9+,11+,12+,13-,14-/m1/s1 |
| InChIKey | ZAPNUFCAIXITRW-LUQFHCQZSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | O[C@@]1([C@@]2([C@@]([C@@]3([C@](C(=C)C1)(CC([C@]3(C)[H])=O)[H])[H])(OC(=O)[C@]2(C)[H])[H])[H])[H] |
| SPLASH | splash10-01b9-9200000000-fd40e5d99b461b71f43e |
| Source of Spectrum | O1-60-628-3 |
| Wiley ID | 1592027 |