| SpectraBase Compound ID | IOt2hwrHkZV |
|---|---|
| InChI | InChI=1S/C20H26O4/c1-10(2)11-8-12-13-9-14-19(3,4)6-5-7-20(14,18(23)24-13)15(12)17(22)16(11)21/h8,10,13-14,21-22H,5-7,9H2,1-4H3/t13-,14?,20+/m0/s1 |
| InChIKey | XUSYGBPHQBWGAD-YFCRFVGBSA-N |
| Mol Weight | 330.42 g/mol |
| Molecular Formula | C20H26O4 |
| Exact Mass | 330.183109 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IWaXsC1rCsX |
|---|---|
| Name | Carnosol |
| CAS Registry Number | 92519-82-9 |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H26O4 |
| InChI | InChI=1S/C20H26O4/c1-10(2)11-8-12-13-9-14-19(3,4)6-5-7-20(14,18(23)24-13)15(12)17(22)16(11)21/h8,10,13-14,21-22H,5-7,9H2,1-4H3/t13-,14?,20+/m0/s1 |
| InChIKey | XUSYGBPHQBWGAD-YFCRFVGBSA-N |
| Molecular Weight | 330.424 g/mol |
| SMILES | Oc1c(c(cc2[C@@]3(CC4C(CCC[C@@]4(c12)C(O3)=O)(C)C)[H])C(C)C)O |
| SPLASH | splash10-000i-0090000000-c3b7d59fc56ece213fb4 |
| Source of Spectrum | F7-8-553-11 |
| Wiley ID | 1556611 |