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(2E,4E,7R,12Z)-14-hydroxy-3,5,7-trimethyl-tetradeca-2,4,12-trienoic acid benzhydryl ester
SpectraBase Compound ID 9IZgnhzbb5d
InChI InChI=1S/C30H38O3/c1-24(15-9-5-4-6-14-20-31)21-25(2)22-26(3)23-29(32)33-30(27-16-10-7-11-17-27)28-18-12-8-13-19-28/h6-8,10-14,16-19,22-24,30-31H,4-5,9,15,20-21H2,1-3H3/b14-6-,25-22+,26-23+/t24-/m1/s1
InChIKey BXQZGCJTWBVZGC-HTWVIOSMSA-N
Mol Weight 446.6 g/mol
Molecular Formula C30H38O3
Exact Mass 446.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ftYFsuB5qe
Name (2E,4E,7R,12Z)-14-hydroxy-3,5,7-trimethyl-tetradeca-2,4,12-trienoic acid benzhydryl ester
Alternate Name(s) (2E,4E,7R,12Z)-14-hydroxy-3,5,7-trimethyltetradeca-2,4,12-trienoic acid (diphenylmethyl) ester (diphenylmethyl) (2E,4E,7R,12Z)-3,5,7-trimethyl-14-oxidanyl-tetradeca-2,4,12-trienoate benzhydryl (2E,4E,7R,12Z)-14-hydroxy-3,5,7-trimethyl-tetradeca-2,4,12-trienoate
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Formula C30H38O3
InChI InChI=1S/C30H38O3/c1-24(15-9-5-4-6-14-20-31)21-25(2)22-26(3)23-29(32)33-30(27-16-10-7-11-17-27)28-18-12-8-13-19-28/h6-8,10-14,16-19,22-24,30-31H,4-5,9,15,20-21H2,1-3H3/b14-6-,25-22+,26-23+/t24-/m1/s1
InChIKey BXQZGCJTWBVZGC-HTWVIOSMSA-N
Molecular Weight 446.631 g/mol
SMILES OC\C=C/CCCC[C@](C\C(=C\C(=C\C(OC(c1ccccc1)c1ccccc1)=O)C)C)(C)[H]
SPLASH splash10-014i-0900000000-64c3e6b7f1c5b3abf8d5
Source of Spectrum KC-0-1921-13
Wiley ID 828546