| SpectraBase Compound ID | 2YFdZMcKC5e |
|---|---|
| InChI | InChI=1S/C15H24O2/c1-10(2)12-6-7-15(3)13(12)8-11(9-16)4-5-14(15)17/h8,10,12-13,16H,4-7,9H2,1-3H3/t12-,13-,15+/m0/s1 |
| InChIKey | GOLVWBBRGXFBMA-KCQAQPDRSA-N |
| Mol Weight | 236.35 g/mol |
| Molecular Formula | C15H24O2 |
| Exact Mass | 236.17763 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FIudGDgcRB5 |
|---|---|
| Name | (1R,3aS,8aS)-1-isopropyl-3a-methyl-7-methylol-1,2,3,5,6,8a-hexahydroazulen-4-one |
| CAS Registry Number | 91410-61-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H24O2 |
| InChI | InChI=1S/C15H24O2/c1-10(2)12-6-7-15(3)13(12)8-11(9-16)4-5-14(15)17/h8,10,12-13,16H,4-7,9H2,1-3H3/t12-,13-,15+/m0/s1 |
| InChIKey | GOLVWBBRGXFBMA-KCQAQPDRSA-N |
| Molecular Weight | 236.355 g/mol |
| SMILES | OCC1=C[C@@]2([C@](C(=O)CC1)(CC[C@]2(C(C)C)[H])C)[H] |
| SPLASH | splash10-054o-9300000000-e7bc0e2c9a77f4bc0731 |
| Source of Spectrum | J-57-5375-3 |
| Synonyms | (1R,3aS,8aS)-7-(hydroxymethyl)-1-isopropyl-3a-methyl-1,2,3,5,6,8a-hexahydroazulen-4-one (1R,3aS,8aS)-7-(hydroxymethyl)-3a-methyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydroazulen-4-one (1S,3aR,8aR)-7-(hydroxymethyl)-1-isopropyl-3a-methyl-1,2,3,5,6,8a-hexahydroazulen-4-one (1S,3aR,8aR)-7-(hydroxymethyl)-3a-methyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydroazulen-4-one |
| Wiley ID | 1238817 |