| SpectraBase Spectrum ID |
BqUdxfLCLa1 |
| Name |
(1S)-1-(2,2,5-trimethyl-1,3-dioxan-5-yl)-4-pentyn-1-ol |
| Alternate Name(s) |
(1S)-1-(2,2,5-trimethyl-1,3-dioxan-5-yl)pent-4-yn-1-ol |
| CAS Registry Number |
129540-01-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H20O3 |
| InChI |
InChI=1S/C12H20O3/c1-5-6-7-10(13)12(4)8-14-11(2,3)15-9-12/h1,10,13H,6-9H2,2-4H3/t10-/m0/s1 |
| InChIKey |
RGYLAWOQFJELPQ-JTQLQIEISA-N |
| Molecular Weight |
212.289 g/mol |
| SMILES |
O[C@](C1(COC(OC1)(C)C)C)(CCC#C)[H] |
| SPLASH |
splash10-0002-0900000000-01fc1e9c319eb63f85bb |
| Source of Spectrum |
J-57-2573-21 |
| Wiley ID |
1211594 |
