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2-Benzyl-6-bromoisoquinolin-1(2H)-one
SpectraBase Compound ID 93ClHzbIsLo
InChI InChI=1S/C16H12BrNO/c17-14-6-7-15-13(10-14)8-9-18(16(15)19)11-12-4-2-1-3-5-12/h1-10H,11H2
InChIKey DAGABNNMLDZJPR-UHFFFAOYSA-N
Mol Weight 314.18 g/mol
Molecular Formula C16H12BrNO
Exact Mass 313.010227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDySixhgHT1
Name 2-Benzyl-6-bromoisoquinolin-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12BrNO
InChI InChI=1S/C16H12BrNO/c17-14-6-7-15-13(10-14)8-9-18(16(15)19)11-12-4-2-1-3-5-12/h1-10H,11H2
InChIKey DAGABNNMLDZJPR-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.orglett.6b00646
Molecular Weight 314.182 g/mol
SMILES C1(N(C=Cc2cc(ccc12)Br)Cc1ccccc1)=O
SPLASH splash10-0006-9044000000-14b670a61c5428d5b6ee
Source of Spectrum A1-18-2036/SM12-5f
Wiley ID 1805355