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Vasnetine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Vasnetine
SpectraBase Compound ID 8kWy69qpokw
InChI InChI=1S/C19H17N3O3/c1-25-19(24)13-7-3-5-9-15(13)20-16-10-11-22-17(16)21-14-8-4-2-6-12(14)18(22)23/h2-9,16,20H,10-11H2,1H3
InChIKey XROLSYQINIGIQK-UHFFFAOYSA-N
Mol Weight 335.36 g/mol
Molecular Formula C19H17N3O3
Exact Mass 335.126991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiF7tWtP94k
Name Vasnetine
Alternate Name(s) 3-[2'-(Methoxycarbonyl)phenylamino]-9-oxo-(dihydro)benzopyrimidino[2,3-a]pyrroline 2-[(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-3-yl)amino]benzoic acid methyl ester Methyl 2-[(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-3-yl)amino]benzoate Methyl 2-[(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-3-yl)amino]benzoate
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Formula C19H17N3O3
InChI InChI=1S/C19H17N3O3/c1-25-19(24)13-7-3-5-9-15(13)20-16-10-11-22-17(16)21-14-8-4-2-6-12(14)18(22)23/h2-9,16,20H,10-11H2,1H3
InChIKey XROLSYQINIGIQK-UHFFFAOYSA-N
Molecular Weight 335.363 g/mol
SMILES N(C1C=2N(C(c3c(cccc3)N2)=O)CC1)c1c(C(=O)OC)cccc1
SPLASH splash10-002r-1269000000-58addebabbccfec28dfc
Source of Spectrum X2-57-961-9
Wiley ID 1605528