| SpectraBase Compound ID | BFGN2wXFfEC |
|---|---|
| InChI | InChI=1S/C29H42O2/c1-20(2)13-15-24(16-14-21(3)4)27(23(7)8)29(9,18-17-22(5)6)28(31)25-11-10-12-26(30)19-25/h10-12,14,17,19,24,27,30H,1,7,13,15-16,18H2,2-6,8-9H3/t24-,27+,29-/m0/s1 |
| InChIKey | MTCPKFHUPWTJSP-HWUUJZMBSA-N |
| Mol Weight | 422.7 g/mol |
| Molecular Formula | C29H42O2 |
| Exact Mass | 422.318481 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | F6RwMH4bJIv |
|---|---|
| Name | 1-(3'-hydroxyphenyl)-3-isopropenyl-2.beta.,7-dimethyl-2,4-di(3-methylbut-2-enyl)oct-7-en-1-one |
| Appearance | Yellow oil |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H42O2 |
| InChI | InChI=1S/C29H42O2/c1-20(2)13-15-24(16-14-21(3)4)27(23(7)8)29(9,18-17-22(5)6)28(31)25-11-10-12-26(30)19-25/h10-12,14,17,19,24,27,30H,1,7,13,15-16,18H2,2-6,8-9H3/t24-,27+,29-/m0/s1 |
| InChIKey | MTCPKFHUPWTJSP-HWUUJZMBSA-N |
| Instrument Name | JMS-HX100 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np050084v |
| Molecular Weight | 422.653 g/mol |
| Optical Rotation | [a]D25 = 210 (c = 0.04, acetone) |
| Reported Formula | C29H42O2 |
| SMILES | Oc1cccc(c1)C([C@]([C@@]([C@](CC=C(C)C)(CCC(=C)C)[H])(C(C)=C)[H])(CC=C(C)C)C)=O |
| SPLASH | splash10-01b9-9500000000-c639e767856f6fc37d34 |
| Source of Spectrum | G4-68-1127-1 |
| Synonyms | Garcinielliptone FA |
| Wiley ID | 1879588 |