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(S)-Methyl 4-(tert-butoxycarbonylamino)-5-methyl-2-hexynoate
SpectraBase Compound ID 3ZDQOzs2N5T
InChI InChI=1S/C13H21NO4/c1-9(2)10(7-8-11(15)17-6)14-12(16)18-13(3,4)5/h9-10H,1-6H3,(H,14,16)/t10-/m1/s1
InChIKey NHBAXFXDKCCJIV-SNVBAGLBSA-N
Mol Weight 255.31 g/mol
Molecular Formula C13H21NO4
Exact Mass 255.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UjqGyIkitr
Name (S)-Methyl 4-(tert-butoxycarbonylamino)-5-methyl-2-hexynoate
Alternate Name(s) methyl (4S)-4-[(tert-butoxycarbonyl)amino]-5-methyl-2-hexynoate
Comments Less than 3 mono-isotopic peaks
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Formula C13H21NO4
InChI InChI=1S/C13H21NO4/c1-9(2)10(7-8-11(15)17-6)14-12(16)18-13(3,4)5/h9-10H,1-6H3,(H,14,16)/t10-/m1/s1
InChIKey NHBAXFXDKCCJIV-SNVBAGLBSA-N
Molecular Weight 255.314 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C#CC(=O)OC)(C(C)C)[H]
SPLASH splash10-0a4i-9000000000-640565af70b7b0be6fca
Source of Spectrum F-54-10222-1
Wiley ID 808573