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4-Bromanyl-3-phenyl-2-prop-2-ynyl-isoquinolin-1-one
SpectraBase Compound ID 4WRHSj1QoHG
InChI InChI=1S/C18H12BrNO/c1-2-12-20-17(13-8-4-3-5-9-13)16(19)14-10-6-7-11-15(14)18(20)21/h1,3-11H,12H2
InChIKey JJXXHFWOSNZQDP-UHFFFAOYSA-N
Mol Weight 338.2 g/mol
Molecular Formula C18H12BrNO
Exact Mass 337.010227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1fiEBe6c9F
Name 4-Bromanyl-3-phenyl-2-prop-2-ynyl-isoquinolin-1-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12BrNO
InChI InChI=1S/C18H12BrNO/c1-2-12-20-17(13-8-4-3-5-9-13)16(19)14-10-6-7-11-15(14)18(20)21/h1,3-11H,12H2
InChIKey JJXXHFWOSNZQDP-UHFFFAOYSA-N
Molecular Weight 338.204 g/mol
SMILES C=1(N(C(c2c(C1Br)cccc2)=O)CC#C)c1ccccc1
SPLASH splash10-000i-0029000000-6edc7408aac3f9d89ecc
Source of Spectrum Y-38-599-7
Synonyms 4-Bromo-3-phenyl-2-prop-2-ynyl-1-isoquinolinone 4-Bromo-3-phenyl-2-prop-2-ynyl-isoquinolin-1-one 4-Bromo-3-phenyl-2-propargyl-isocarbostyril
Wiley ID 848369