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(S,R,R)-2-(2,6,10-Trimethyl-1(E),5(E),9-tridecatrienyl)-5-[(phenylmethoxy)methyl]-2,3,4,5-tetrahydrofuran-3-methol
SpectraBase Compound ID 9ciQpXsQ4pV
InChI InChI=1S/C27H40O3/c1-21(2)10-8-11-22(3)12-9-13-23(4)16-27-25(18-28)17-26(30-27)20-29-19-24-14-6-5-7-15-24/h5-7,10,12,14-16,25-28H,8-9,11,13,17-20H2,1-4H3/b22-12+,23-16+/t25-,26+,27-/m1/s1
InChIKey MGBKIJQAWZXOMH-AVYGXUOBSA-N
Mol Weight 412.6 g/mol
Molecular Formula C27H40O3
Exact Mass 412.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DgScXnaZiGI
Name (S,R,R)-2-(2,6,10-Trimethyl-1(E),5(E),9-tridecatrienyl)-5-[(phenylmethoxy)methyl]-2,3,4,5-tetrahydrofuran-3-methol
Alternate Name(s) (5S,2R,3R)-2-(2,6,10-Trimethyl-1(E),5(E),undeca-1,5,9-trienyl)-5-[(phenylmethoxy)-methyl]-2,3,4,5-tetrahydro-furan-3-methanol
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Formula C27H40O3
InChI InChI=1S/C27H40O3/c1-21(2)10-8-11-22(3)12-9-13-23(4)16-27-25(18-28)17-26(30-27)20-29-19-24-14-6-5-7-15-24/h5-7,10,12,14-16,25-28H,8-9,11,13,17-20H2,1-4H3/b22-12+,23-16+/t25-,26+,27-/m1/s1
InChIKey MGBKIJQAWZXOMH-AVYGXUOBSA-N
Molecular Weight 412.614 g/mol
SMILES OC[C@@]1([C@](O[C@](COCc2ccccc2)(C1)[H])(\C=C\(CC\C=C\(CCC=C(C)C)C)C)[H])[H]
SPLASH splash10-0w2c-0092300000-65bd619de30b383bf8f4
Source of Spectrum J-62-6606-20
Wiley ID 1374667