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(Z)-2-Ethoxycarbonylamino-4-morpholin-4-yl-6-oxo-2-trifluoromethyl-hept-4-enoic acid methyl ester
SpectraBase Compound ID CEAqsbv5LUB
InChI InChI=1S/C16H23F3N2O6/c1-4-27-14(24)20-15(13(23)25-3,16(17,18)19)10-12(9-11(2)22)21-5-7-26-8-6-21/h9H,4-8,10H2,1-3H3,(H,20,24)/b12-9-
InChIKey KXUZPNYLEYTSKZ-XFXZXTDPSA-N
Mol Weight 396.36 g/mol
Molecular Formula C16H23F3N2O6
Exact Mass 396.150821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EZ7nmWSzxIH
Name (Z)-2-Ethoxycarbonylamino-4-morpholin-4-yl-6-oxo-2-trifluoromethyl-hept-4-enoic acid methyl ester
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Formula C16H23F3N2O6
InChI InChI=1S/C16H23F3N2O6/c1-4-27-14(24)20-15(13(23)25-3,16(17,18)19)10-12(9-11(2)22)21-5-7-26-8-6-21/h9H,4-8,10H2,1-3H3,(H,20,24)/b12-9-
InChIKey KXUZPNYLEYTSKZ-XFXZXTDPSA-N
Molecular Weight 396.363 g/mol
SMILES N(C(C(F)(F)F)(C\C(=C\C(=O)C)N1CCOCC1)C(=O)OC)C(=O)OCC
SPLASH splash10-0002-0109000000-70ac9292608e87091408
Source of Spectrum F4-0-1628-9
Synonyms Methyl (4Z)-2-[(ethoxycarbonyl)amino]-4-(4-morpholinyl)-6-oxo-2-(trifluoromethyl)-4-heptenoate Methyl 2-[(Ethoxycarbonyl)amino]-4-(morpholin-4-yl)-6-oxo-2-(trifluoromethyl)hept-4-endioate
Wiley ID 1619822