| SpectraBase Compound ID | FAbI7GCY8iq |
|---|---|
| InChI | InChI=1S/C30H50O2/c1-20-21(32)8-9-22-26(20,4)11-10-23-27(22,5)13-14-29(7)24-18-25(2,3)12-16-30(24,19-31)17-15-28(23,29)6/h20,22-24,31H,8-19H2,1-7H3 |
| InChIKey | YPWQSKQSNNTXOL-UHFFFAOYSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C30H50O2 |
| Exact Mass | 442.381081 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KcRvA4z85XZ |
|---|---|
| Name | D:A-Friedooleanan-3-one, 28-hydroxy- |
| Alternate Name(s) | 8a-(Hydroxymethyl)-4,4a,6b,11,11,12b,14a-heptamethylicosahydro-3(2H)-picenone Canophyllol 4,4a,6a,6b,11,11,14a-heptamethyl-8a-methylol-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one 8a-(hydroxymethyl)-4,4a,6a,6b,11,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one 8a-(hydroxymethyl)-4,4a,6b,11,11,12b,14a-heptamethylicosahydropicen-3(2H)-one |
| CAS Registry Number | 14440-41-6 |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O2 |
| InChI | InChI=1S/C30H50O2/c1-20-21(32)8-9-22-26(20,4)11-10-23-27(22,5)13-14-29(7)24-18-25(2,3)12-16-30(24,19-31)17-15-28(23,29)6/h20,22-24,31H,8-19H2,1-7H3 |
| InChIKey | YPWQSKQSNNTXOL-UHFFFAOYSA-N |
| Molecular Weight | 442.728 g/mol |
| SMILES | OCC12CCC3(C(C1CC(C)(C)CC2)(CCC1(C3CCC2(C(C(=O)CCC12)C)C)C)C)C |
| SPLASH | splash10-0a4l-0009800000-9e0b704742225d2acb32 |
| Source of Spectrum | QA-44-323-3 |
| Wiley ID | 862445 |