| SpectraBase Compound ID | HridjcyVlw7 |
|---|---|
| InChI | InChI=1S/C15H26O2/c1-9-5-6-12-10(2)14(16)8-11(7-13(9)12)15(3,4)17/h6,9-11,13-14,16-17H,5,7-8H2,1-4H3/t9-,10+,11-,13-,14-/m0/s1 |
| InChIKey | IFELKEXDSVYIOJ-WTNWGCMGSA-N |
| Mol Weight | 238.37 g/mol |
| Molecular Formula | C15H26O2 |
| Exact Mass | 238.19328 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2yetDf7nRQZ |
|---|---|
| Name | 1-Guaiene-9.beta.,11-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H26O2 |
| InChI | InChI=1S/C15H26O2/c1-9-5-6-12-10(2)14(16)8-11(7-13(9)12)15(3,4)17/h6,9-11,13-14,16-17H,5,7-8H2,1-4H3/t9-,10+,11-,13-,14-/m0/s1 |
| InChIKey | IFELKEXDSVYIOJ-WTNWGCMGSA-N |
| Molecular Weight | 238.371 g/mol |
| SMILES | OC([C@]1(C[C@@]2(C([C@]([C@](C1)(O)[H])(C)[H])=CC[C@@]2(C)[H])[H])[H])(C)C |
| SPLASH | splash10-006t-0970000000-1664e557dff0ef3b2aa7 |
| Source of Spectrum | G4-70-852-2 |
| Synonyms | 3,8-Dimethyl-5-(.alpha.-hydroxyisopropyl)-7-hydroxy-perhydro-.delta.-1(8a)-azulene (1S,4R,5S,7S,8aS)-7-(2-hydroxypropan-2-yl)-1,4-dimethyl-1,2,4,5,6,7,8,8a-octahydroazulen-5-ol (1S,4R,5S,7S,8aS)-1,4-dimethyl-7-(2-oxidanylpropan-2-yl)-1,2,4,5,6,7,8,8a-octahydroazulen-5-ol |
| Wiley ID | 1694700 |