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25C-NB4OMe TFA derivative
SpectraBase Compound ID GBwqAWu18PT
InChI InChI=1S/C20H21ClF3NO4/c1-27-15-6-4-13(5-7-15)12-25(19(26)20(22,23)24)9-8-14-10-18(29-3)16(21)11-17(14)28-2/h4-7,10-11H,8-9,12H2,1-3H3
InChIKey OBDZJAZJPOJGGA-UHFFFAOYSA-N
Mol Weight 431.84 g/mol
Molecular Formula C20H21ClF3NO4
Exact Mass 431.11112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ArvfKzQly2u
Name 25C-NB4OMe TFA derivative
Alternate Name(s) 2C-C-NB4OMe TFA derivative N-(4-chloro-2,5-dimethoxyphenethyl)-2,2,2-trifluoro-N-(4-methoxybenzyl)acetamide
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Formula C20H21ClF3NO4
InChI InChI=1S/C20H21ClF3NO4/c1-27-15-6-4-13(5-7-15)12-25(19(26)20(22,23)24)9-8-14-10-18(29-3)16(21)11-17(14)28-2/h4-7,10-11H,8-9,12H2,1-3H3
InChIKey OBDZJAZJPOJGGA-UHFFFAOYSA-N
Molecular Weight 431.839 g/mol
SMILES C(C(=O)N(CCc1cc(c(cc1OC)Cl)OC)Cc1ccc(cc1)OC)(F)(F)F
SPLASH splash10-00dj-2900000000-c813cc0e4784f37e86c6
Source of Spectrum SWG-33-4086-0
Wiley ID 1810737