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Ethyl 2-(benzylamino)-2-{[(benzyloxy)carbonyl]amino}-3,3,3-trifluoropropanoate
SpectraBase Compound ID 62ulTwiobNh
InChI InChI=1S/C20H21F3N2O4/c1-2-28-17(26)19(20(21,22)23,24-13-15-9-5-3-6-10-15)25-18(27)29-14-16-11-7-4-8-12-16/h3-12,24H,2,13-14H2,1H3,(H,25,27)
InChIKey RTLNJMKZIQTLPN-UHFFFAOYSA-N
Mol Weight 410.39 g/mol
Molecular Formula C20H21F3N2O4
Exact Mass 410.145342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYBsBc3uWGY
Name Ethyl 2-(benzylamino)-2-{[(benzyloxy)carbonyl]amino}-3,3,3-trifluoropropanoate
Alternate Name(s) Propanoic acid, 3,3,3-trifluoro-2-[[(phenylmethoxy)carbonyl]amino]-2-[(phenylmethyl)amino]-, ethyl ester 3,3,3-trifluoro-2-(phenylmethoxycarbonylamino)-2-[(phenylmethyl)amino]propanoic acid ethyl ester Ethyl 2-(benzylamino)-3,3,3-trifluoro-2-(phenylmethoxycarbonylamino)propanoate Ethyl 2-(benzylamino)-2-(benzyloxycarbonylamino)-3,3,3-trifluoro-propanoate Ethyl 3,3,3-tris(fluoranyl)-2-(phenylmethoxycarbonylamino)-2-[(phenylmethyl)amino]propanoate
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Formula C20H21F3N2O4
InChI InChI=1S/C20H21F3N2O4/c1-2-28-17(26)19(20(21,22)23,24-13-15-9-5-3-6-10-15)25-18(27)29-14-16-11-7-4-8-12-16/h3-12,24H,2,13-14H2,1H3,(H,25,27)
InChIKey RTLNJMKZIQTLPN-UHFFFAOYSA-N
Molecular Weight 410.393 g/mol
SMILES N(C(OCc1ccccc1)=O)C(NCc1ccccc1)(C(F)(F)F)C(OCC)=O
SPLASH splash10-0006-9400000000-fcc66bb7bb62e4dba0f4
Source of Spectrum IY-2-5052-9
Wiley ID 1658512