| SpectraBase Compound ID | 4lWrIbo2WGN |
|---|---|
| InChI | InChI=1S/C32H52O2/c1-21(2)11-10-12-22(3)24-15-19-32(9)26-13-14-27-29(5,6)28(34-23(4)33)17-18-30(27,7)25(26)16-20-31(24,32)8/h11,16,22,24,26-28H,10,12-15,17-20H2,1-9H3/t22-,24+,26+,27-,28-,30+,31+,32-/m0/s1 |
| InChIKey | LUYVRICDGSTYQC-KMSPPIGWSA-N |
| Mol Weight | 468.8 g/mol |
| Molecular Formula | C32H52O2 |
| Exact Mass | 468.396731 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HmyTMu9ZHGR |
|---|---|
| Name | (20S)-parkeol acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H52O2 |
| InChI | InChI=1S/C32H52O2/c1-21(2)11-10-12-22(3)24-15-19-32(9)26-13-14-27-29(5,6)28(34-23(4)33)17-18-30(27,7)25(26)16-20-31(24,32)8/h11,16,22,24,26-28H,10,12-15,17-20H2,1-9H3/t22-,24+,26+,27-,28-,30+,31+,32-/m0/s1 |
| InChIKey | LUYVRICDGSTYQC-KMSPPIGWSA-N |
| Instrument Name | JEOL SX 100 or JEOL JMS-Q1000 GC K9 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/cbic.201900314 |
| Molecular Weight | 468.766 g/mol |
| Reported Formula | C32H52O2 |
| SMILES | C[C@@]12C3=CC[C@]4(C)[C@@]([H])([C@@](C)(CCC=C(C)C)[H])CC[C@@]4(C)[C@]3([H])CC[C@]1(C(C)(C)[C@@](OC(=O)C)(CC2)[H])[H] |
| SPLASH | splash10-066r-6922000000-778ba10130a1eaf33857 |
| Source of Spectrum | CBC-20-SM42-13-acetate |
| Synonyms | 20-epi-Parkeol acetate |
| Wiley ID | 1838411 |