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Tetrahydrogermanin A - methyl ester - monodeuterated cpd.
SpectraBase Compound ID FzntF0rmvNv
InChI InChI=1S/C16H24O5/c1-9-5-4-6-11(16(19)20-3)8-12(17)14-10(2)15(18)21-13(14)7-9/h6,9-10,12-14,17H,4-5,7-8H2,1-3H3/b11-6-/i17D
InChIKey ZZTJRCKYXIEMFE-CFKPUIFISA-N
Mol Weight 297.37 g/mol
Molecular Formula C16H232DO5
Exact Mass 297.168651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1tSzXv9Gm0D
Name Tetrahydrogermanin A - methyl ester - monodeuterated cpd.
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Formula C16H23DO5
InChI InChI=1S/C16H24O5/c1-9-5-4-6-11(16(19)20-3)8-12(17)14-10(2)15(18)21-13(14)7-9/h6,9-10,12-14,17H,4-5,7-8H2,1-3H3/b11-6-/i17D
InChIKey ZZTJRCKYXIEMFE-CFKPUIFISA-N
Molecular Weight 297.369 g/mol
SMILES C1(OC2CC(CC\C=C\(CC(C2C1C)O[2D])C(=O)OC)C)=O
SPLASH splash10-0a4i-5290000000-18d351802c0ee8c00fd4
Source of Spectrum X4-14-283-0
Synonyms Methyl 4,4'-dimethyl-8-[(deuterio)hydroxy]-5'-oxo-(tetrahydro)-furano[2',3'-6,7]cyclodec-1(10)-ene-10-carboxylate
Wiley ID 1585246