| SpectraBase Compound ID | 94rRT9LJq3w |
|---|---|
| InChI | InChI=1S/C17H26O3/c1-12-7-8-14-13(16(12,2)10-11-18)6-5-9-17(14,3)15(19)20-4/h6,11-12,14H,5,7-10H2,1-4H3/t12-,14+,16+,17+/m1/s1 |
| InChIKey | WCTUFKTZOGXOBM-QCPWZWHMSA-N |
| Mol Weight | 278.39 g/mol |
| Molecular Formula | C17H26O3 |
| Exact Mass | 278.188195 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6tanLbiim0f |
|---|---|
| Name | Methyl 12-Oxo-13,14,15,16-tetranor-ent-halima-1(10)-en-18-oate |
| Alternate Name(s) | (1S,5S,6R,8aS)-1,5,6-trimethyl-5-(2-oxoethyl)-2,3,6,7,8,8a-hexahydronaphthalene-1-carboxylic acid methyl ester Methyl (1S,5S,6R,8aS)-1,5,6-trimethyl-5-(2-oxoethyl)-2,3,6,7,8,8a-hexahydronaphthalene-1-carboxylate Methyl (1S,5S,6R,8aS)-1,5,6-trimethyl-5-(2-oxidanylideneethyl)-2,3,6,7,8,8a-hexahydronaphthalene-1-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H26O3 |
| InChI | InChI=1S/C17H26O3/c1-12-7-8-14-13(16(12,2)10-11-18)6-5-9-17(14,3)15(19)20-4/h6,11-12,14H,5,7-10H2,1-4H3/t12-,14+,16+,17+/m1/s1 |
| InChIKey | WCTUFKTZOGXOBM-QCPWZWHMSA-N |
| Molecular Weight | 278.392 g/mol |
| SMILES | C1=2[C@@]([C@](C(=O)OC)(C)CCC2)(CC[C@]([C@@]1(CC=O)C)(C)[H])[H] |
| SPLASH | splash10-0059-0980000000-803267403b09fdfa8870 |
| Source of Spectrum | F4-0-3869-5 |
| Wiley ID | 1621039 |