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2-acetyl-3,4-dihydro-1H-isoquinoline-1-carboxylic acid ethyl ester
SpectraBase Compound ID 6njpX9RYyxC
InChI InChI=1S/C14H17NO3/c1-3-18-14(17)13-12-7-5-4-6-11(12)8-9-15(13)10(2)16/h4-7,13H,3,8-9H2,1-2H3
InChIKey FAQKHOIUSGSMQU-UHFFFAOYSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mokngy52c3
Name 2-acetyl-3,4-dihydro-1H-isoquinoline-1-carboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-3-18-14(17)13-12-7-5-4-6-11(12)8-9-15(13)10(2)16/h4-7,13H,3,8-9H2,1-2H3
InChIKey FAQKHOIUSGSMQU-UHFFFAOYSA-N
Molecular Weight 247.294 g/mol
SMILES C1(N(CCc2ccccc12)C(=O)C)C(=O)OCC
SPLASH splash10-001i-0900000000-2aec8c21c3fd7d83b7df
Source of Spectrum E1-45-1251-0
Synonyms ethyl 2-acetyl-3,4-dihydro-1H-isoquinoline-1-carboxylate ethyl 2-ethanoyl-3,4-dihydro-1H-isoquinoline-1-carboxylate
Wiley ID 1553998