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1-Fluoro-4-(2-methyl-3-pentylcyclobut-1-en-1-yl)benzene
SpectraBase Compound ID ApYRWqNHfJj
InChI InChI=1S/C16H21F/c1-3-4-5-6-14-11-16(12(14)2)13-7-9-15(17)10-8-13/h7-10,14H,3-6,11H2,1-2H3
InChIKey ILAKSWQDWMRGQK-UHFFFAOYSA-N
Mol Weight 232.34 g/mol
Molecular Formula C16H21F
Exact Mass 232.162729 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGJpA7LAtDx
Name 1-Fluoro-4-(2-methyl-3-pentylcyclobut-1-en-1-yl)benzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.162728839 u
Formula C16H21F
InChI InChI=1S/C16H21F/c1-3-4-5-6-14-11-16(12(14)2)13-7-9-15(17)10-8-13/h7-10,14H,3-6,11H2,1-2H3
InChIKey ILAKSWQDWMRGQK-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201604585
Molecular Weight 232.342 g/mol
Quality 137
Reported Formula C16H21F
SMILES C1(F)=CC=C(C=C1)C1=C(C(C1)CCCCC)C
SPLASH splash10-08is-0900000000-7c59aa7d89af518dff6d
Source of Spectrum QE-23-SM32-20b (DOI: 10.1002/chem.201604585)
Thin-Layer Chromatography 0.88 (hexane, UV, KMnO4)
Wiley ID 1903881