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Methyl 4-[1,2,3,4-tetrahydro-6,7-dimethoxy-1-methylideneispquinoline-2-yl]-4-oxo-2,3-dihydroxybutanoate
SpectraBase Compound ID JCvx0E228mw
InChI InChI=1S/C17H21NO7/c1-9-11-8-13(24-3)12(23-2)7-10(11)5-6-18(9)16(21)14(19)15(20)17(22)25-4/h7-8,14-15,19-20H,1,5-6H2,2-4H3/t14-,15-/m1/s1
InChIKey KQGOGBUNBPJMRF-HUUCEWRRSA-N
Mol Weight 351.36 g/mol
Molecular Formula C17H21NO7
Exact Mass 351.131802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fa84COw5s2Z
Name Methyl 4-[1,2,3,4-tetrahydro-6,7-dimethoxy-1-methylideneispquinoline-2-yl]-4-oxo-2,3-dihydroxybutanoate
Alternate Name(s) Methyl (2R,3R)-4-(6,7-dimethoxy-1-methylene-3,4-dihydro-2(1H)-isoquinolinyl)-2,3-dihydroxy-4-oxobutanoate
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Formula C17H21NO7
InChI InChI=1S/C17H21NO7/c1-9-11-8-13(24-3)12(23-2)7-10(11)5-6-18(9)16(21)14(19)15(20)17(22)25-4/h7-8,14-15,19-20H,1,5-6H2,2-4H3/t14-,15-/m1/s1
InChIKey KQGOGBUNBPJMRF-HUUCEWRRSA-N
Molecular Weight 351.355 g/mol
SMILES O[C@]([C@](C(N1C(c2cc(OC)c(cc2CC1)OC)=C)=O)(O)[H])(C(=O)OC)[H]
SPLASH splash10-0a4r-0195000000-bb10263a37c26b18114b
Source of Spectrum H1-34-950-5
Wiley ID 754628