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3-(5-bromoindol-1-yl)indolin-2-one
SpectraBase Compound ID 9kdnyUPX4A0
InChI InChI=1S/C16H11BrN2O/c17-11-5-6-14-10(9-11)7-8-19(14)15-12-3-1-2-4-13(12)18-16(15)20/h1-9,15H,(H,18,20)
InChIKey PCXCEVQKRTXJIS-UHFFFAOYSA-N
Mol Weight 327.18 g/mol
Molecular Formula C16H11BrN2O
Exact Mass 326.005476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EBmvzAo9xka
Name 3-(5-bromoindol-1-yl)indolin-2-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11BrN2O
InChI InChI=1S/C16H11BrN2O/c17-11-5-6-14-10(9-11)7-8-19(14)15-12-3-1-2-4-13(12)18-16(15)20/h1-9,15H,(H,18,20)
InChIKey PCXCEVQKRTXJIS-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010 or Agilent 5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910864
Molecular Weight 327.181 g/mol
Reported Formula C16H11N2O(79)Br
SMILES N1C(C(c2c1cccc2)[n]1ccc2cc(Br)ccc12)=O
SPLASH splash10-003s-0904000000-152fc9a660666c26b8db
Source of Spectrum ACI-59-SM17-4r
Wiley ID 1856846