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N-(Pentan-3-yl)-4-phenoxyaniline
SpectraBase Compound ID GSGUshVLDtv
InChI InChI=1S/C17H21NO/c1-3-14(4-2)18-15-10-12-17(13-11-15)19-16-8-6-5-7-9-16/h5-14,18H,3-4H2,1-2H3
InChIKey JWBBAFGOPJWSKB-UHFFFAOYSA-N
Mol Weight 255.36 g/mol
Molecular Formula C17H21NO
Exact Mass 255.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5uy5twgwLF
Name N-(Pentan-3-yl)-4-phenoxyaniline
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO
InChI InChI=1S/C17H21NO/c1-3-14(4-2)18-15-10-12-17(13-11-15)19-16-8-6-5-7-9-16/h5-14,18H,3-4H2,1-2H3
InChIKey JWBBAFGOPJWSKB-UHFFFAOYSA-N
Instrument Name Waters Q-TOF Premier
Ionization Type EI
Literature Reference DOI 10.1002/chem.201904502
Molecular Weight 255.361 g/mol
Reported Formula C17H21NO
SMILES N(c1ccc(cc1)Oc1ccccc1)C(CC)CC
SPLASH splash10-056r-0090000000-d1c1c7f7b5f3064c5f87
Source of Spectrum QE-26-SM11-3m
Thin-Layer Chromatography Rf = 0.32 (SiO2, PE/MTBE, 20:1)
Wiley ID 1858499