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N-Boc-N-methyl-L-valine methyl ester
SpectraBase Compound ID 7Y0fWEstZvI
InChI InChI=1S/C12H23NO4/c1-8(2)9(10(14)16-7)13(6)11(15)17-12(3,4)5/h8-9H,1-7H3/t9-/m0/s1
InChIKey JHELVJNRWQYMIA-VIFPVBQESA-N
Mol Weight 245.32 g/mol
Molecular Formula C12H23NO4
Exact Mass 245.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqhQ38NU2NS
Name N-Boc-N-methyl-L-valine methyl ester
Alternate Name(s) (S)-methyl 2-((tert-butoxycarbonyl)(methyl)amino)-3-methylbutanoate (2S)-3-methyl-2-[methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid methyl ester Methyl (2S)-2-[tert-butoxycarbonyl(methyl)amino]-3-methyl-butanoate Methyl (2S)-3-methyl-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]butanoate
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Formula C12H23NO4
InChI InChI=1S/C12H23NO4/c1-8(2)9(10(14)16-7)13(6)11(15)17-12(3,4)5/h8-9H,1-7H3/t9-/m0/s1
InChIKey JHELVJNRWQYMIA-VIFPVBQESA-N
Literature Reference DOI 10.1039/c3ra46599c
Molecular Weight 245.319 g/mol
SMILES C(N([C@](C(=O)OC)(C(C)C)[H])C)(=O)OC(C)(C)C
SPLASH splash10-053i-9600000000-50c277ac7c2e430880eb
Source of Spectrum RSA-4-2685-arb1
Wiley ID 1747900