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1-acetyl-5-bromo-3-(1-fluoro-2-oxo-2-phenyl-ethylidene)indolin-2-one
SpectraBase Compound ID ABdCReKaHJx
InChI InChI=1S/C18H11BrFNO3/c1-10(22)21-14-8-7-12(19)9-13(14)15(18(21)24)16(20)17(23)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey LMDXOYNVZVPHIX-UHFFFAOYSA-N
Mol Weight 388.19 g/mol
Molecular Formula C18H11BrFNO3
Exact Mass 386.990634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2NSq5K7kvHg
Name 1-acetyl-5-bromo-3-(1-fluoro-2-oxo-2-phenyl-ethylidene)indolin-2-one
Appearance Orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.990634378 u
Formula C18H11BrFNO3
InChI InChI=1S/C18H11BrFNO3/c1-10(22)21-14-8-7-12(19)9-13(14)15(18(21)24)16(20)17(23)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey LMDXOYNVZVPHIX-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.201611625
Molecular Weight 388.192 g/mol
Quality 73
Reported Formula C18H11NO3F(79)Br
SMILES C1(=CC2=C(C=C1)N(C(C2=C(F)C(=O)C1=CC=CC=C1)=O)C(C)=O)Br
SPLASH splash10-0a6r-7934000000-aaa7a31c7dfc77f223f8
Source of Spectrum ACI-56-SM21-8e (DOI: 10.1002/anie.201611625)
Wiley ID 1892927