| SpectraBase Spectrum ID |
CiHE4FlBZqN |
| Name |
Ethyl (E)-2-ethyl-5-acetoxy-3-hexenoate |
| Alternate Name(s) |
(2S,5R,E)-ethyl 5-acetoxy-2-ethylhex-3-enoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H20O4 |
| InChI |
InChI=1S/C12H20O4/c1-5-11(12(14)15-6-2)8-7-9(3)16-10(4)13/h7-9,11H,5-6H2,1-4H3/b8-7+/t9-,11+/m1/s1 |
| InChIKey |
QTWXQPCCFMDHNE-KLCSSHHSSA-N |
| Literature Reference DOI |
10.1021/ol800727f |
| Molecular Weight |
228.288 g/mol |
| SMILES |
C[C@](\C=C\[C@@](C(OCC)=O)(CC)[H])(OC(=O)C)[H] |
| SPLASH |
splash10-015c-6900000000-8a23f40b5ea0cf373bae |
| Source of Spectrum |
A1-10-2087/SMS4-5b |
| Wiley ID |
1759472 |
