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5-Isopropyl-2-methyl-3-(4-fluorobenzylamino)-1,4-benzoquinone
SpectraBase Compound ID CRhCa5uGrk
InChI InChI=1S/C17H18FNO2/c1-10(2)14-8-15(20)11(3)16(17(14)21)19-9-12-4-6-13(18)7-5-12/h4-8,10,19H,9H2,1-3H3
InChIKey HKMLXKLYWKZVPM-UHFFFAOYSA-N
Mol Weight 287.33 g/mol
Molecular Formula C17H18FNO2
Exact Mass 287.132157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gkyFc5Zjs
Name 5-Isopropyl-2-methyl-3-(4-fluorobenzylamino)-1,4-benzoquinone
Appearance Dark red crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18FNO2
InChI InChI=1S/C17H18FNO2/c1-10(2)14-8-15(20)11(3)16(17(14)21)19-9-12-4-6-13(18)7-5-12/h4-8,10,19H,9H2,1-3H3
InChIKey HKMLXKLYWKZVPM-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 287.334 g/mol
SMILES N(C=1C(C(C(C)C)=CC(C1C)=O)=O)Cc1ccc(cc1)F
SPLASH splash10-0550-0960000000-276489941baf36bfdee3
Source of Spectrum US10501428B2
Thin-Layer Chromatography Rf = 0.530
Wiley ID 1875008