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Methyl 7-hydroxy-8-isoquinoln-1-yloct-2-ynoate
SpectraBase Compound ID 4naKbKkPGR0
InChI InChI=1S/C18H19NO3/c1-22-18(21)10-4-2-3-8-15(20)13-17-16-9-6-5-7-14(16)11-12-19-17/h5-7,9,11-12,15,20H,2-3,8,13H2,1H3
InChIKey TYBCNXWFPNTRBX-UHFFFAOYSA-N
Mol Weight 297.35 g/mol
Molecular Formula C18H19NO3
Exact Mass 297.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzhEqtGzv7Y
Name Methyl 7-hydroxy-8-isoquinoln-1-yloct-2-ynoate
Alternate Name(s) 7-Hydroxy-8-(1-isoquinolinyl)-2-octynoic acid methyl ester Methyl 7-hydroxy-8-isoquinolin-1-yloct-2-ynoate Methyl 7-hydroxy-8-(1-isoquinolyl)oct-2-ynoate Methyl 8-isoquinolin-1-yl-7-oxidanyl-oct-2-ynoate
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Formula C18H19NO3
InChI InChI=1S/C18H19NO3/c1-22-18(21)10-4-2-3-8-15(20)13-17-16-9-6-5-7-14(16)11-12-19-17/h5-7,9,11-12,15,20H,2-3,8,13H2,1H3
InChIKey TYBCNXWFPNTRBX-UHFFFAOYSA-N
Molecular Weight 297.354 g/mol
SMILES OC(Cc1nccc2c1cccc2)CCCC#CC(=O)OC
SPLASH splash10-00kf-0920000000-40c256e22b3008c5cd74
Source of Spectrum KC-57-1774-8
Wiley ID 1623021