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3-Fluoro-N-(pentan-3-yl)aniline
SpectraBase Compound ID 6ASCRz3buQM
InChI InChI=1S/C11H16FN/c1-3-10(4-2)13-11-7-5-6-9(12)8-11/h5-8,10,13H,3-4H2,1-2H3
InChIKey OCORGQFMMGRYGV-UHFFFAOYSA-N
Mol Weight 181.25 g/mol
Molecular Formula C11H16FN
Exact Mass 181.126678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87JDDsmWleI
Name 3-Fluoro-N-(pentan-3-yl)aniline
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16FN
InChI InChI=1S/C11H16FN/c1-3-10(4-2)13-11-7-5-6-9(12)8-11/h5-8,10,13H,3-4H2,1-2H3
InChIKey OCORGQFMMGRYGV-UHFFFAOYSA-N
Instrument Name Waters Q-TOF Premier
Ionization Type EI
Literature Reference DOI 10.1002/chem.201904502
Molecular Weight 181.254 g/mol
Reported Formula C11H16FN
SMILES N(c1cccc(c1)F)C(CC)CC
SPLASH splash10-0udi-1900000000-7652249a8ffd6ac9270c
Source of Spectrum QE-26-SM7-3f
Thin-Layer Chromatography Rf = 0.27 (SiO2, PE/MTBE, 30:1)
Wiley ID 1858495