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(2E,4E,7R)-11-[(2R,3S)-3-(hydroxymethyl)-2-oxiranyl]-3,5,7-trimethylundeca-2,4-dienoic acid (diphenylmethyl) ester
SpectraBase Compound ID IMqXBUfeSHw
InChI InChI=1S/C30H38O4/c1-22(12-10-11-17-27-28(21-31)33-27)18-23(2)19-24(3)20-29(32)34-30(25-13-6-4-7-14-25)26-15-8-5-9-16-26/h4-9,13-16,19-20,22,27-28,30-31H,10-12,17-18,21H2,1-3H3/b23-19+,24-20+/t22-,27-,28+/m1/s1
InChIKey PWHGTTXQOFWMCA-BNDSGZOXSA-N
Mol Weight 462.6 g/mol
Molecular Formula C30H38O4
Exact Mass 462.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NeMoeLbwaH
Name (2E,4E,7R)-11-[(2R,3S)-3-(hydroxymethyl)-2-oxiranyl]-3,5,7-trimethylundeca-2,4-dienoic acid (diphenylmethyl) ester
Alternate Name(s) (2E,4E,7R)-3,5,7-trimethyl-11-[(2R,3S)-3-methyloloxiran-2-yl]undeca-2,4-dienoic acid benzhydryl ester (diphenylmethyl) (2E,4E,7R)-11-[(2R,3S)-3-(hydroxymethyl)oxiran-2-yl]-3,5,7-trimethyl-undeca-2,4-dienoate benzhydryl (2E,4E,7R)-11-[(2R,3S)-3-(hydroxymethyl)oxiran-2-yl]-3,5,7-trimethyl-undeca-2,4-dienoate
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Formula C30H38O4
InChI InChI=1S/C30H38O4/c1-22(12-10-11-17-27-28(21-31)33-27)18-23(2)19-24(3)20-29(32)34-30(25-13-6-4-7-14-25)26-15-8-5-9-16-26/h4-9,13-16,19-20,22,27-28,30-31H,10-12,17-18,21H2,1-3H3/b23-19+,24-20+/t22-,27-,28+/m1/s1
InChIKey PWHGTTXQOFWMCA-BNDSGZOXSA-N
Molecular Weight 462.630 g/mol
SMILES OC[C@@]1(O[C@@]1(CCCC[C@](C\C(=C\C(=C\C(OC(c1ccccc1)c1ccccc1)=O)C)C)(C)[H])[H])[H]
SPLASH splash10-014i-0900000000-42e663e4ad0c871bafb2
Source of Spectrum KC-0-1921-14
Wiley ID 828545