| SpectraBase Spectrum ID |
1alu6IVYGSL |
| Name |
(2R,4R,5R)-4-Ethynyl-2-(4-methoxyphenyl)-5-methyl-1,3-dioxane |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H16O3 |
| InChI |
InChI=1S/C14H16O3/c1-4-13-10(2)9-16-14(17-13)11-5-7-12(15-3)8-6-11/h1,5-8,10,13-14H,9H2,2-3H3/t10-,13+,14-/m1/s1 |
| InChIKey |
MEYAYNSTLCCREM-DDTOSNHZSA-N |
| Instrument Name |
Finnigan MAT 8200 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201804988 |
| Molecular Weight |
232.279 g/mol |
| Optical Rotation |
[a]D20 = +0.6 (c = 1.3, CHCl3) |
| Reported Formula |
C14H16O3 |
| SMILES |
C1[C@@](C)([C@@](O[C@@](O1)(c1ccc(cc1)OC)[H])(C#C)[H])[H] |
| SPLASH |
splash10-000i-4900000000-58c1b812227eb5162a8d |
| Source of Spectrum |
QE-25-SM4-6 |
| Wiley ID |
1846008 |
