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(2S)-1-BENZYLOXY-2-(TERT.-BUTOXYCARBONYL)-AMINO-4,4,4-TRIFLUOROBUTANE
SpectraBase Compound ID 3YmX3gpkIvN
InChI InChI=1S/C16H22F3NO3/c1-15(2,3)23-14(21)20-13(9-16(17,18)19)11-22-10-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,20,21)/t13-/m0/s1
InChIKey JOEXNYZARLYUMY-ZDUSSCGKSA-N
Mol Weight 333.35 g/mol
Molecular Formula C16H22F3NO3
Exact Mass 333.155178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5jaI5vRrIL
Name N-[(1S)-1-(benzoxymethyl)-3,3,3-trifluoro-propyl]carbamic acid tert-butyl ester
Alternate Name(s) N-[(2S)-4,4,4-trifluoro-1-phenylmethoxybutan-2-yl]carbamic acid tert-butyl ester tert-Butyl N-[(1S)-1-(benzyloxymethyl)-3,3,3-trifluoro-propyl]carbamate tert-Butyl N-[(2S)-4,4,4-trifluoro-1-phenylmethoxybutan-2-yl]carbamate tert-Butyl N-[(2S)-4,4,4-tris(fluoranyl)-1-phenylmethoxy-butan-2-yl]carbamate
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Formula C16H22F3NO3
InChI InChI=1S/C16H22F3NO3/c1-15(2,3)23-14(21)20-13(9-16(17,18)19)11-22-10-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,20,21)/t13-/m0/s1
InChIKey JOEXNYZARLYUMY-ZDUSSCGKSA-N
Molecular Weight 333.351 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](CC(F)(F)F)(COCc1ccccc1)[H]
SPLASH splash10-0a4l-9110000000-fcbd3ac35b1a661da14b
Source of Spectrum F-68-7547-13
Wiley ID 1573386