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6-(Phenylmethyl)-2-[(2,3,3,3-tetrafluoro-2-methoxy-1-oxopropyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
SpectraBase Compound ID 8HGhli3n6be
InChI InChI=1S/C21H22F4N2O4S/c1-3-31-18(28)16-14-9-10-27(11-13-7-5-4-6-8-13)12-15(14)32-17(16)26-19(29)20(22,30-2)21(23,24)25/h4-8H,3,9-12H2,1-2H3,(H,26,29)
InChIKey GKASWJNGBXWXPH-UHFFFAOYSA-N
Mol Weight 474.47 g/mol
Molecular Formula C21H22F4N2O4S
Exact Mass 474.123641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dq72XcqnVb
Name 6-(Phenylmethyl)-2-[(2,3,3,3-tetrafluoro-2-methoxy-1-oxopropyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
Alternate Name(s) 6-Benzyl-2-[(2,3,3,3-tetrafluoro-2-methoxy-propanoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester Ethyl 6-(phenylmethyl)-2-[[2,3,3,3-tetrakis(fluoranyl)-2-methoxy-propanoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Ethyl 6-benzyl-2-[(2,3,3,3-tetrafluoro-2-methoxy-propanoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Ethyl 6-benzyl-2-[(2,3,3,3-tetrafluoro-2-methoxypropanoyl)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
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Formula C21H22F4N2O4S
InChI InChI=1S/C21H22F4N2O4S/c1-3-31-18(28)16-14-9-10-27(11-13-7-5-4-6-8-13)12-15(14)32-17(16)26-19(29)20(22,30-2)21(23,24)25/h4-8H,3,9-12H2,1-2H3,(H,26,29)
InChIKey GKASWJNGBXWXPH-UHFFFAOYSA-N
Molecular Weight 474.471 g/mol
SMILES N(C(C(C(F)(F)F)(F)OC)=O)c1c(c2CCN(Cc2s1)Cc1ccccc1)C(=O)OCC
SPLASH splash10-0596-9337800000-fc28c76ce459da5f9cdb
Wiley ID 1464209