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5-(4-Fluorophenyl)benzo[c][1,2,5]oxadiazole
SpectraBase Compound ID 2sL67waZzTH
InChI InChI=1S/C12H7FN2O/c13-10-4-1-8(2-5-10)9-3-6-11-12(7-9)15-16-14-11/h1-7H
InChIKey ASVPOEMBGHBAHQ-UHFFFAOYSA-N
Mol Weight 214.2 g/mol
Molecular Formula C12H7FN2O
Exact Mass 214.054241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRveQW3SKoD
Name 5-(4-Fluorophenyl)benzo[c][1,2,5]oxadiazole
Appearance Light-yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 214.054241015 u
Formula C12H7FN2O
InChI InChI=1S/C12H7FN2O/c13-10-4-1-8(2-5-10)9-3-6-11-12(7-9)15-16-14-11/h1-7H
InChIKey ASVPOEMBGHBAHQ-UHFFFAOYSA-N
Instrument Name Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.202005282
Molecular Weight 214.199 g/mol
Quality 436
Reported Formula C12H7FN2O
SMILES C1(F)=CC=C(C=C1)C=1C=CC=2C(=NON2)C1
SPLASH splash10-0bu0-1930000000-8279443b8c9efdcaa810
Source of Spectrum QE-27-SM21-2q (DOI: 10.1002/chem.202005282)
Thin-Layer Chromatography 0.44 (hexane/EtOAc, 9:1, UV, KMnO4, PAA)
Wiley ID 1901954