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7,8-secoeupalmerin-15-carboxylic acid methyl ester
SpectraBase Compound ID J1bIIJbfFxX
InChI InChI=1S/C20H34O8/c1-12(7-6-8-13(2)21)17(24)18-14(19(25)27-5)11-15(22)20(3,28-18)10-9-16(23)26-4/h12,14-15,17-18,22,24H,6-11H2,1-5H3/t12-,14+,15+,17-,18?,20-/m0/s1
InChIKey FJDXMYNEHWZSGG-OBFFICITSA-N
Mol Weight 402.5 g/mol
Molecular Formula C20H34O8
Exact Mass 402.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBOtPCagoRL
Name 7,8-secoeupalmerin-15-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O8
InChI InChI=1S/C20H34O8/c1-12(7-6-8-13(2)21)17(24)18-14(19(25)27-5)11-15(22)20(3,28-18)10-9-16(23)26-4/h12,14-15,17-18,22,24H,6-11H2,1-5H3/t12-,14+,15+,17-,18?,20-/m0/s1
InChIKey FJDXMYNEHWZSGG-OBFFICITSA-N
Molecular Weight 402.484 g/mol
SMILES O[C@@]1(C[C@](C([C@]([C@](CCCC(=O)C)(C)[H])(O)[H])O[C@]1(CCC(=O)OC)C)(C(=O)OC)[H])[H]
SPLASH splash10-0002-7921000000-60b48534ef92993fe035
Source of Spectrum J-66-657-31
Wiley ID 1534313