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Gnetin-a - tetraacetate
SpectraBase Compound ID 4HxWXqKKXZc
InChI InChI=1S/C36H30O10/c1-19(37)43-27-11-6-23(7-12-27)5-8-25-17-31(41)35-32(24-9-13-28(14-10-24)44-20(2)38)33(34(25)36(35)42)26-15-29(45-21(3)39)18-30(16-26)46-22(4)40/h5-18,32-35H,1-4H3/b8-5+/t32-,33-,34+,35-/m1/s1
InChIKey PVDBGSUECLNVMK-PGPTWCPESA-N
Mol Weight 622.6 g/mol
Molecular Formula C36H30O10
Exact Mass 622.183897 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5KewhgYPb4W
Name Gnetin-a - tetraacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H30O10
InChI InChI=1S/C36H30O10/c1-19(37)43-27-11-6-23(7-12-27)5-8-25-17-31(41)35-32(24-9-13-28(14-10-24)44-20(2)38)33(34(25)36(35)42)26-15-29(45-21(3)39)18-30(16-26)46-22(4)40/h5-18,32-35H,1-4H3/b8-5+/t32-,33-,34+,35-/m1/s1
InChIKey PVDBGSUECLNVMK-PGPTWCPESA-N
Molecular Weight 622.626 g/mol
SMILES [C@]12(C([C@]([H])([C@@]([C@]2(c2ccc(OC(=O)C)cc2)[H])(c2cc(OC(=O)C)cc(c2)OC(=O)C)[H])C(=CC1=O)\C=C\c1ccc(OC(=O)C)cc1)=O)[H]
SPLASH splash10-00dj-9821011000-a8c66e892f375bcca31a
Source of Spectrum X2-45-760-1
Wiley ID 1601067