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5-Isopropyl-2-methyl-3-(4-trifluoromethylbenzylamino)-1,4-benzoquinone
SpectraBase Compound ID DnuHGiLAdbN
InChI InChI=1S/C18H18F3NO2/c1-10(2)14-8-15(23)11(3)16(17(14)24)22-9-12-4-6-13(7-5-12)18(19,20)21/h4-8,10,22H,9H2,1-3H3
InChIKey OSPDWPMAERXNAD-UHFFFAOYSA-N
Mol Weight 337.34 g/mol
Molecular Formula C18H18F3NO2
Exact Mass 337.128963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FxLXHYtV2
Name 5-Isopropyl-2-methyl-3-(4-trifluoromethylbenzylamino)-1,4-benzoquinone
Appearance Dark red crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18F3NO2
InChI InChI=1S/C18H18F3NO2/c1-10(2)14-8-15(23)11(3)16(17(14)24)22-9-12-4-6-13(7-5-12)18(19,20)21/h4-8,10,22H,9H2,1-3H3
InChIKey OSPDWPMAERXNAD-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 337.342 g/mol
SMILES N(C=1C(C(C(C)C)=CC(C1C)=O)=O)Cc1ccc(cc1)C(F)(F)F
SPLASH splash10-000f-0905000000-b96e8a42bd96470203ee
Source of Spectrum US10501428B2
Thin-Layer Chromatography Rf = 0.485
Wiley ID 1875007