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25D-NB4OMe TFA derivative
SpectraBase Compound ID 9tmfQngcZJA
InChI InChI=1S/C21H24F3NO4/c1-14-11-19(29-4)16(12-18(14)28-3)9-10-25(20(26)21(22,23)24)13-15-5-7-17(27-2)8-6-15/h5-8,11-12H,9-10,13H2,1-4H3
InChIKey OWCILZMQBOIYEX-UHFFFAOYSA-N
Mol Weight 411.42 g/mol
Molecular Formula C21H24F3NO4
Exact Mass 411.165743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqF2yCK8wJe
Name 25D-NB4OMe TFA derivative
Alternate Name(s) 2C-D-NB4OMe TFA derivative N-(2,5-dimethoxy-4-methylphenethyl)-2,2,2-trifluoro-N-(4-methoxybenzyl)acetamide
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Formula C21H24F3NO4
InChI InChI=1S/C21H24F3NO4/c1-14-11-19(29-4)16(12-18(14)28-3)9-10-25(20(26)21(22,23)24)13-15-5-7-17(27-2)8-6-15/h5-8,11-12H,9-10,13H2,1-4H3
InChIKey OWCILZMQBOIYEX-UHFFFAOYSA-N
Molecular Weight 411.421 g/mol
SMILES C(C(=O)N(CCc1cc(c(cc1OC)C)OC)Cc1ccc(cc1)OC)(F)(F)F
SPLASH splash10-004i-2900000000-9158b2f13bf4b036ab95
Source of Spectrum SWG-33-4085-0
Wiley ID 1810736