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HHTGGHAUHMIFEH-UHFFFAOYSA-N
SpectraBase Compound ID 3wsA5qlzsyp
InChI InChI=1S/C15H16F2N2O4/c1-22-13(20)15(12(16)17,8-5-9-18)19-14(21)23-10-11-6-3-2-4-7-11/h2-4,6-7,12H,9-10,18H2,1H3,(H,19,21)
InChIKey HHTGGHAUHMIFEH-UHFFFAOYSA-N
Mol Weight 326.3 g/mol
Molecular Formula C15H16F2N2O4
Exact Mass 326.107813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61Kk1dksqUB
Name Methyl 5-Amino-.alpha.-N-(benzyloxycarbonyl)amino-.alpha.-(difluoromethyl)pent-3-yn-1-oate
Alternate Name(s) Methyl 5-amino-2-{[(benzyloxy)carbonyl]amino}-2-(difluoromethyl)-3-pentynoate
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Formula C15H16F2N2O4
InChI InChI=1S/C15H16F2N2O4/c1-22-13(20)15(12(16)17,8-5-9-18)19-14(21)23-10-11-6-3-2-4-7-11/h2-4,6-7,12H,9-10,18H2,1H3,(H,19,21)
InChIKey HHTGGHAUHMIFEH-UHFFFAOYSA-N
Molecular Weight 326.300 g/mol
SMILES N(C(C#CCN)(C(=O)OC)C(F)F)C(=O)OCc1ccccc1
SPLASH splash10-03di-0219000000-c83d89abd1a428e6926f
Source of Spectrum J-66-132-8
Wiley ID 1534202