| SpectraBase Spectrum ID |
BWvJUIn264o |
| Name |
rel-(2S,3S)-Ethyl 2-Allyl-3-hydroxy-4,4-dimethylpentanoate |
| Alternate Name(s) |
ethyl (2S)-2-[(1S)-1-hydroxy-2,2-dimethylpropyl]-4-pentenoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H22O3 |
| InChI |
InChI=1S/C12H22O3/c1-6-8-9(11(14)15-7-2)10(13)12(3,4)5/h6,9-10,13H,1,7-8H2,2-5H3/t9-,10-/m0/s1 |
| InChIKey |
VRXAYMLXMUDKNE-UWVGGRQHSA-N |
| Molecular Weight |
214.305 g/mol |
| SMILES |
O[C@@]([C@@](C(=O)OCC)(CC=C)[H])(C(C)(C)C)[H] |
| SPLASH |
splash10-0a4i-0910000000-f4b3d4fee148758db3a1 |
| Source of Spectrum |
J-57-4469-44 |
| Wiley ID |
1213647 |
