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2-(1,5-DIMETHYL-4-HEXENYL)-3-HYDROXY-5-METHYL-6-PHENYLAMINE-1,4-BENZOQUINONE
SpectraBase Compound ID 6Vicj8Wthdt
InChI InChI=1S/C21H25NO3/c1-13(2)9-8-10-14(3)17-20(24)18(15(4)19(23)21(17)25)22-16-11-6-5-7-12-16/h5-7,9,11-12,14,22,25H,8,10H2,1-4H3
InChIKey VAYAEVFXLLDIRZ-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9B4GpnThgCC
Name 2-(1,5-DIMETHYL-4-HEXENYL)-3-HYDROXY-5-METHYL-6-PHENYLAMINE-1,4-BENZOQUINONE
Compound Number APZ
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-13(2)9-8-10-14(3)17-20(24)18(15(4)19(23)21(17)25)22-16-11-6-5-7-12-16/h5-7,9,11-12,14,22,25H,8,10H2,1-4H3
InChIKey VAYAEVFXLLDIRZ-UHFFFAOYSA-N
Literature Reference Author M.AGUILAR-MARTINEZ,J.A.BAUTISTA-MARTINEZ,N.MACIAS-RUVALCABA, I.GONZALES,E.TOVAR,
Literature Reference Citation J.ORG.CHEM.,66,8349(2001)
Literature Reference DOI 10.1021/jo010302z
Molecular Weight 339.434 g/mol
Solvent CDCl3
Source File Reference UWLU29098