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Isoviolacein methyl ether
SpectraBase Compound ID FquNQ7Bym9R
InChI InChI=1S/C21H15N3O3/c1-27-11-6-7-17-13(8-11)19(21(26)23-17)14-9-18(24-20(14)25)15-10-22-16-5-3-2-4-12(15)16/h2-10,22H,1H3,(H,23,26)(H,24,25)/b19-14+
InChIKey VKSKIPIQJXBDOT-XMHGGMMESA-N
Mol Weight 357.37 g/mol
Molecular Formula C21H15N3O3
Exact Mass 357.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ClYF08Dcql8
Name Isoviolacein methyl ether
Alternate Name(s) (3E)-3-[5-(1H-indol-3-yl)-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]-5-methoxy-1,3-dihydro-2H-indol-2-one
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Formula C21H15N3O3
InChI InChI=1S/C21H15N3O3/c1-27-11-6-7-17-13(8-11)19(21(26)23-17)14-9-18(24-20(14)25)15-10-22-16-5-3-2-4-12(15)16/h2-10,22H,1H3,(H,23,26)(H,24,25)/b19-14+
InChIKey VKSKIPIQJXBDOT-XMHGGMMESA-N
Molecular Weight 357.369 g/mol
SMILES N1c2c(\C(=C\3C=C(c4c[nH]c5c4cccc5)NC3=O)C1=O)cc(cc2)OC
SPLASH splash10-0a4i-2219000000-8f798c7ca68d1e2a026c
Source of Spectrum KC-1984-1337-0
Wiley ID 1346528