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(2E)-2-(8-acetoxy-1H-quinolin-2-ylidene)-3-keto-butyric acid methyl ester
SpectraBase Compound ID K3VnOxcKD1z
InChI InChI=1S/C16H15NO5/c1-9(18)14(16(20)21-3)12-8-7-11-5-4-6-13(15(11)17-12)22-10(2)19/h4-8,17H,1-3H3/b14-12+
InChIKey NSNHBHNSMBHVKO-WYMLVPIESA-N
Mol Weight 301.3 g/mol
Molecular Formula C16H15NO5
Exact Mass 301.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zphcYmuUwm
Name (2E)-2-(8-acetoxy-1H-quinolin-2-ylidene)-3-keto-butyric acid methyl ester
Alternate Name(s) (2E)-2-(8-acetyloxy-1H-quinolin-2-ylidene)-3-oxobutanoic acid methyl ester methyl (2E)-2-(8-acetoxy-1H-quinolin-2-ylidene)-3-oxo-butanoate methyl (2E)-2-(8-acetyloxy-1H-quinolin-2-ylidene)-3-oxidanylidene-butanoate methyl (2E)-2-(8-acetyloxy-1H-quinolin-2-ylidene)-3-oxobutanoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H15NO5
InChI InChI=1S/C16H15NO5/c1-9(18)14(16(20)21-3)12-8-7-11-5-4-6-13(15(11)17-12)22-10(2)19/h4-8,17H,1-3H3/b14-12+
InChIKey NSNHBHNSMBHVKO-WYMLVPIESA-N
Molecular Weight 301.298 g/mol
SMILES N1c2c(cccc2C=C\C1=C\(C(=O)OC)C(=O)C)OC(=O)C
SPLASH splash10-000i-0905000000-59864ae36443596047c9
Source of Spectrum KC-0-1206-10
Wiley ID 824863