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2-benzoyl-3,4-dihydro-1H-isoquinoline-1-carboxylic acid ethyl ester
SpectraBase Compound ID BNNpurl4em
InChI InChI=1S/C19H19NO3/c1-2-23-19(22)17-16-11-7-6-8-14(16)12-13-20(17)18(21)15-9-4-3-5-10-15/h3-11,17H,2,12-13H2,1H3
InChIKey MDQJJHAFYGHIML-UHFFFAOYSA-N
Mol Weight 309.37 g/mol
Molecular Formula C19H19NO3
Exact Mass 309.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbwpdoERUbC
Name 2-benzoyl-3,4-dihydro-1H-isoquinoline-1-carboxylic acid ethyl ester
Alternate Name(s) ethyl 2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-1-carboxylate ethyl 2-benzoyl-3,4-dihydro-1H-isoquinoline-1-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C19H19NO3
InChI InChI=1S/C19H19NO3/c1-2-23-19(22)17-16-11-7-6-8-14(16)12-13-20(17)18(21)15-9-4-3-5-10-15/h3-11,17H,2,12-13H2,1H3
InChIKey MDQJJHAFYGHIML-UHFFFAOYSA-N
Molecular Weight 309.365 g/mol
SMILES C1(N(CCc2ccccc12)C(c1ccccc1)=O)C(=O)OCC
SPLASH splash10-0a4i-0900000000-0731e1769359b03bbff1
Source of Spectrum E1-45-1251-0
Wiley ID 1553999