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21.alpha.-Hydroxyserrat-14-en-3.beta.-yl dihydrocaffeate
SpectraBase Compound ID 40Sb0Zftg5r
InChI InChI=1S/C39H58O5/c1-35(2)29-13-10-25-23-37(5)19-16-30-36(3,4)33(44-34(43)15-9-24-8-12-27(40)28(41)22-24)18-21-39(30,7)31(37)14-11-26(25)38(29,6)20-17-32(35)42/h8,10,12,22,26,29-33,40-42H,9,11,13-21,23H2,1-7H3/t26-,29-,30-,31-,32-,33-,37-,38+,39-/m0/s1
InChIKey LRDNGJPHSOZKDQ-WQTAACKQSA-N
Mol Weight 606.9 g/mol
Molecular Formula C39H58O5
Exact Mass 606.428425 g/mol
Enantiomer InChIKey LRDNGJPHSOZKDQ-MCNXTJGVSA-N
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Source of Spectrum G4-66-1331-2

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Wiley Registry of Mass Spectral Data 2023

Author: Wiley

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