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1-Fluoro-4-(2-methyl-3-octylcyclobut-1-en-1-yl)benzene
SpectraBase Compound ID HRBDfpEWa4W
InChI InChI=1S/C19H27F/c1-3-4-5-6-7-8-9-17-14-19(15(17)2)16-10-12-18(20)13-11-16/h10-13,17H,3-9,14H2,1-2H3
InChIKey KNTHXMDKEYQOLL-UHFFFAOYSA-N
Mol Weight 274.42 g/mol
Molecular Formula C19H27F
Exact Mass 274.209679 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JaBU4JmTW93
Name 1-Fluoro-4-(2-methyl-3-octylcyclobut-1-en-1-yl)benzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.209679032 u
Formula C19H27F
InChI InChI=1S/C19H27F/c1-3-4-5-6-7-8-9-17-14-19(15(17)2)16-10-12-18(20)13-11-16/h10-13,17H,3-9,14H2,1-2H3
InChIKey KNTHXMDKEYQOLL-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 274.423 g/mol
Quality 73
SMILES C1(F)=CC=C(C=C1)C1=C(C(C1)CCCCCCCC)C
SPLASH splash10-03fs-0900000000-53f9645e0388797ebe4f
Source of Spectrum QE-23-SM24-18c (DOI: 10.1002/chem.201604585)
Thin-Layer Chromatography 0.85 (hexane, UV, KMnO4)
Wiley ID 1903869