| SpectraBase Spectrum ID |
G4JREN2tOEy |
| Name |
[(5Z,7E,9E,11E)-tetradeca-5,7,9,11-tetraenyl] (2R)-3-methyl-2-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoyl]oxy-butanoate |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H37F3O5 |
| InChI |
InChI=1S/C29H37F3O5/c1-5-6-7-8-9-10-11-12-13-14-15-19-22-36-26(33)25(23(2)3)37-27(34)28(35-4,29(30,31)32)24-20-17-16-18-21-24/h6-13,16-18,20-21,23,25H,5,14-15,19,22H2,1-4H3/b7-6+,9-8+,11-10+,13-12-/t25-,28-/m1/s1 |
| InChIKey |
RHCYUILZKGRVQB-NULZXRLESA-N |
| Instrument Name |
Hewlett-Packard 6890N-5975B |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.0c00437 |
| Molecular Weight |
522.605 g/mol |
| SMILES |
c1([C@](C(O[C@](C(C)C)(C(OCCCC\C=C/C=C/C=C/C=C/CC)=O)[H])=O)(OC)C(F)(F)F)ccccc1 |
| SPLASH |
splash10-001c-2900000000-504ab278d2ab78e50569 |
| Source of Spectrum |
G4-83-2912-(R)-MTPA-1 |
| Wiley ID |
1876845 |
![[(5Z,7E,9E,11E)-tetradeca-5,7,9,11-tetraenyl] (2R)-3-methyl-2-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoyl]oxy-butanoate](/api/spectrum/G4JREN2tOEy/structure.png?h=300&w=458 "[(5Z,7E,9E,11E)-tetradeca-5,7,9,11-tetraenyl] (2R)-3-methyl-2-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoyl]oxy-butanoate")
