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2-(1-isoquinolinyl)acetic acid tert-butyl ester
SpectraBase Compound ID JdjZVMyUbvW
InChI InChI=1S/C15H17NO2/c1-15(2,3)18-14(17)10-13-12-7-5-4-6-11(12)8-9-16-13/h4-9H,10H2,1-3H3
InChIKey UEXBRFKTUAGQQZ-UHFFFAOYSA-N
Mol Weight 243.31 g/mol
Molecular Formula C15H17NO2
Exact Mass 243.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHzZJ75XxVc
Name 2-(1-isoquinolinyl)acetic acid tert-butyl ester
Alternate Name(s) 2-(1-isoquinolyl)acetic acid tert-butyl ester tert-Butyl 2-(1-isoquinolyl)acetate tert-Butyl 2-isoquinolin-1-ylacetate tert-Butyl 2-isoquinolin-1-ylethanoate
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Formula C15H17NO2
InChI InChI=1S/C15H17NO2/c1-15(2,3)18-14(17)10-13-12-7-5-4-6-11(12)8-9-16-13/h4-9H,10H2,1-3H3
InChIKey UEXBRFKTUAGQQZ-UHFFFAOYSA-N
Molecular Weight 243.306 g/mol
SMILES C(c1nccc2c1cccc2)C(OC(C)(C)C)=O
SPLASH splash10-0a4l-9700000000-0f0576bd9694984e6551
Source of Spectrum AJ-73-2808-9
Wiley ID 775571