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5-Fluoro-1,1-dimethyl-3-phenyl-1H-isoindole 2-Oxide
SpectraBase Compound ID CN4z2Z5Yff6
InChI InChI=1S/C16H14FNO/c1-16(2)14-9-8-12(17)10-13(14)15(18(16)19)11-6-4-3-5-7-11/h3-10H,1-2H3
InChIKey BIAMOZCPAZDQSS-UHFFFAOYSA-N
Mol Weight 255.29 g/mol
Molecular Formula C16H14FNO
Exact Mass 255.105942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FijfMw0QY02
Name 5-Fluoro-1,1-dimethyl-3-phenyl-1H-isoindole 2-Oxide
Appearance Beige crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.105942237 u
Formula C16H14FNO
InChI InChI=1S/C16H14FNO/c1-16(2)14-9-8-12(17)10-13(14)15(18(16)19)11-6-4-3-5-7-11/h3-10H,1-2H3
InChIKey BIAMOZCPAZDQSS-UHFFFAOYSA-N
Instrument Name Waters AutoSpec Premier
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.2c02797
Molecular Weight 255.292 g/mol
Quality 212
Reported Formula C16H14NOF
SMILES C1=CC2=C(C=C1F)C(=[N+](C2(C)C)[O-])C1=CC=CC=C1
SPLASH splash10-0a4l-1190000000-eecca22e63538cba7efb
Source of Spectrum JOC-88-2389-2f (DOI: 10.1021/acs.joc.2c02797)
Thin-Layer Chromatography 0.28 (Hexane/EtOAc, 2:1)
Wiley ID 1912634