| SpectraBase Spectrum ID |
57Z2dEgtPCu |
| Name |
4-[(2S,3S)-3-[(1Z,3E)-tetradeca-1,3-dienyl]-2-oxiranyl]butanoic acid methyl ester |
| Alternate Name(s) |
4-[(2S,3S)-3-[(1Z,3E)-tetradeca-1,3-dienyl]oxiran-2-yl]butyric acid methyl ester
methyl 4-[(2S,3S)-3-[(1Z,3E)-tetradeca-1,3-dienyl]oxiran-2-yl]butanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H36O3 |
| InChI |
InChI=1S/C21H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-19-20(24-19)17-15-18-21(22)23-2/h12-14,16,19-20H,3-11,15,17-18H2,1-2H3/b13-12+,16-14-/t19-,20-/m0/s1 |
| InChIKey |
ZBLJRTGQUJEKJU-MHYKMTAESA-N |
| Molecular Weight |
336.516 g/mol |
| SMILES |
[C@@]1(O[C@]1(CCCC(=O)OC)[H])(\C=C/C=C/CCCCCCCCCC)[H] |
| SPLASH |
splash10-004i-0901000000-f19824aae02687a74851 |
| Source of Spectrum |
J-58-1081-3 |
| Wiley ID |
1332730 |
![4-[(2S,3S)-3-[(1Z,3E)-tetradeca-1,3-dienyl]-2-oxiranyl]butanoic acid methyl ester](/api/spectrum/57Z2dEgtPCu/structure.png?h=300&w=458 "4-[(2S,3S)-3-[(1Z,3E)-tetradeca-1,3-dienyl]-2-oxiranyl]butanoic acid methyl ester")
