| SpectraBase Compound ID | AWafoKk1MmU |
|---|---|
| InChI | InChI=1S/C32H52O2/c1-20(2)22-10-15-29(6)16-11-25-31(8)17-12-23-28(4,5)26(34-21(3)33)14-19-30(23,7)24(31)13-18-32(25,9)27(22)29/h11,20,22-24,26-27H,10,12-19H2,1-9H3/t22-,23?,24?,26+,27-,29-,30+,31-,32-/m1/s1 |
| InChIKey | SBKIZMQGLSLFLB-KWJAKOHISA-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 | Ee2vUsQ4yfx |
|---|---|
| Name | Lactuc-14-en-3.beta.-yl acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H52O2 |
| InChI | InChI=1S/C32H52O2/c1-20(2)22-10-15-29(6)16-11-25-31(8)17-12-23-28(4,5)26(34-21(3)33)14-19-30(23,7)24(31)13-18-32(25,9)27(22)29/h11,20,22-24,26-27H,10,12-19H2,1-9H3/t22-,23?,24?,26+,27-,29-,30+,31-,32-/m1/s1 |
| InChIKey | SBKIZMQGLSLFLB-KWJAKOHISA-N |
| Molecular Weight | 468.766 g/mol |
| SMILES | [C@]12(C([C@@]3(CCC4[C@@](C3CC2)(CC[C@](OC(=O)C)(C4(C)C)[H])C)C)=CC[C@@]2([C@]1([C@](CC2)(C(C)C)[H])[H])C)C |
| SPLASH | splash10-0kml-0694000000-c89e424d018147f33d15 |
| Source of Spectrum | E1-40-1686-0 |
| Wiley ID | 1519485 |