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7-[carbethoxy-(carbethoxyamino)amino]-7-(4-fluorophenyl)enanthic acid methyl ester
SpectraBase Compound ID JFxYZw92Heb
InChI InChI=1S/C20H29FN2O6/c1-4-28-19(25)22-23(20(26)29-5-2)17(15-11-13-16(21)14-12-15)9-7-6-8-10-18(24)27-3/h11-14,17H,4-10H2,1-3H3,(H,22,25)
InChIKey FVSKZSXARYPWBV-UHFFFAOYSA-N
Mol Weight 412.46 g/mol
Molecular Formula C20H29FN2O6
Exact Mass 412.200965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DpqTfvwQa
Name 7-[carbethoxy-(carbethoxyamino)amino]-7-(4-fluorophenyl)enanthic acid methyl ester
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Formula C20H29FN2O6
InChI InChI=1S/C20H29FN2O6/c1-4-28-19(25)22-23(20(26)29-5-2)17(15-11-13-16(21)14-12-15)9-7-6-8-10-18(24)27-3/h11-14,17H,4-10H2,1-3H3,(H,22,25)
InChIKey FVSKZSXARYPWBV-UHFFFAOYSA-N
Molecular Weight 412.458 g/mol
SMILES N(N(C(=O)OCC)C(c1ccc(cc1)F)CCCCCC(=O)OC)C(=O)OCC
SPLASH splash10-0a4r-0980000000-18ae781cccc4e05e5db4
Source of Spectrum KC-0-1025-11
Synonyms 7-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-7-(4-fluorophenyl)heptanoic acid methyl ester Methyl 7-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-7-(4-fluorophenyl)heptanoate
Wiley ID 785581