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N-[(1S)-1-[[[(2S)-2-(tert-butoxycarbonylamino)-3-methyl-butyl]thio]methyl]-2-methyl-propyl]carbamic acid tert-butyl ester

View entire compound with spectra: 1 MS (GC)

N-[(1S)-1-[[[(2S)-2-(tert-butoxycarbonylamino)-3-methyl-butyl]thio]methyl]-2-methyl-propyl]carbamic acid tert-butyl ester
SpectraBase Compound ID FTRkR3h5IA3
InChI InChI=1S/C20H40N2O4S/c1-13(2)15(21-17(23)25-19(5,6)7)11-27-12-16(14(3)4)22-18(24)26-20(8,9)10/h13-16H,11-12H2,1-10H3,(H,21,23)(H,22,24)/t15-,16-/m1/s1
InChIKey RYNDOHHXUNZAHI-HZPDHXFCSA-N
Mol Weight 404.6 g/mol
Molecular Formula C20H40N2O4S
Exact Mass 404.270879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Emj2ElmzWod
Name N-[(1S)-1-[[[(2S)-2-(tert-butoxycarbonylamino)-3-methyl-butyl]thio]methyl]-2-methyl-propyl]carbamic acid tert-butyl ester
Alternate Name(s) N-[(2S)-3-methyl-1-[[(2S)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butyl]thio]butan-2-yl]carbamic acid tert-butyl ester tert-Butyl N-[(1S)-1-[[(2S)-2-(tert-butoxycarbonylamino)-3-methyl-butyl]sulfanylmethyl]-2-methyl-propyl]carbamate tert-Butyl N-[(2S)-3-methyl-1-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]sulfanyl-butan-2-yl]carbamate
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Formula C20H40N2O4S
InChI InChI=1S/C20H40N2O4S/c1-13(2)15(21-17(23)25-19(5,6)7)11-27-12-16(14(3)4)22-18(24)26-20(8,9)10/h13-16H,11-12H2,1-10H3,(H,21,23)(H,22,24)/t15-,16-/m1/s1
InChIKey RYNDOHHXUNZAHI-HZPDHXFCSA-N
Molecular Weight 404.610 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](CSC[C@@](NC(OC(C)(C)C)=O)(C(C)C)[H])(C(C)C)[H]
SPLASH splash10-052b-5292000000-aa29f5e5a1ebd2912faf
Source of Spectrum U1-1999-1477-9
Wiley ID 752961