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(+)-(S)-3-{[(4E,6E,8E)-Dodeca-4,6,8-trienyl]oxy}-2-hydroxypropyl 4-Hydroxybenzoate
SpectraBase Compound ID 7RA75fqs1TP
InChI InChI=1S/C22H30O5/c1-2-3-4-5-6-7-8-9-10-11-16-26-17-21(24)18-27-22(25)19-12-14-20(23)15-13-19/h4-9,12-15,21,23-24H,2-3,10-11,16-18H2,1H3/b5-4+,7-6+,9-8+/t21-/m0/s1
InChIKey GPOOJUQRKZSJIB-JUZBPIOXSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EyE7qt19E2V
Name (+)-(S)-3-{[(4E,6E,8E)-Dodeca-4,6,8-trienyl]oxy}-2-hydroxypropyl 4-Hydroxybenzoate
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Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-2-3-4-5-6-7-8-9-10-11-16-26-17-21(24)18-27-22(25)19-12-14-20(23)15-13-19/h4-9,12-15,21,23-24H,2-3,10-11,16-18H2,1H3/b5-4+,7-6+,9-8+/t21-/m0/s1
InChIKey GPOOJUQRKZSJIB-JUZBPIOXSA-N
Literature Reference DOI 10.1002/hlca.19910740504
Molecular Weight 374.477 g/mol
SMILES Oc1ccc(C(OC[C@](COCCC\C=C\C=C\C=C\CCC)(O)[H])=O)cc1
SPLASH splash10-00xr-8900000000-fe67749142f6bd110dd3
Source of Spectrum H-74-949-(+)_2
Synonyms (S)-3-(((4E,6E,8E)-dodeca-4,6,8-trien-1-yl)oxy)-2-hydroxypropyl 4-hydroxybenzoate
Wiley ID 1789271