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Triticone E
SpectraBase Compound ID BkG4dy3mPHG
InChI InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11-,13+,14+/m0/s1
InChIKey FFIHXENRVXVAGQ-KZZKGCKGSA-N
Mol Weight 297.31 g/mol
Molecular Formula C14H19NO6
Exact Mass 297.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JU9Re6aNOr
Name Triticone E
Alternate Name(s) (3R,4R,5S,6Z,10R)-3,4,10-trihydroxy-2-methoxy-3-methyl-6-propylidene-2-azaspiro[4.5]dec-7-ene-1,9-dione (3R,4R,5S,6Z,10R)-2-methoxy-3-methyl-3,4,10-tris(oxidanyl)-6-propylidene-2-azaspiro[4.5]dec-7-ene-1,9-dione
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Formula C14H19NO6
InChI InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11-,13+,14+/m0/s1
InChIKey FFIHXENRVXVAGQ-KZZKGCKGSA-N
Molecular Weight 297.307 g/mol
SMILES O[C@]1([C@](N(C([C@]11[C@](C(C=C\C1=C/CC)=O)(O)[H])=O)OC)(O)C)[H]
SPLASH splash10-0201-0940000000-762d2ae8559c1c603932
Source of Spectrum X2-56-754-5
Wiley ID 1604900