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l-Valine, N-isobutoxycarbonyl-, heptyl ester
SpectraBase Compound ID 7GvnepM4ojv
InChI InChI=1S/C17H33NO4/c1-6-7-8-9-10-11-21-16(19)15(14(4)5)18-17(20)22-12-13(2)3/h13-15H,6-12H2,1-5H3,(H,18,20)
InChIKey RTVXYMUYSQCOIR-UHFFFAOYSA-N
Mol Weight 315.5 g/mol
Molecular Formula C17H33NO4
Exact Mass 315.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AyKgvan3k8
Name l-Valine, N-isobutoxycarbonyl-, heptyl ester
Alternate Name(s) 3-Methyl-2-[[2-methylpropoxy(oxo)methyl]amino]butanoic acid heptyl ester Heptyl 2-(isobutoxycarbonylamino)-3-methyl-butanoate Heptyl 3-methyl-2-(2-methylpropoxycarbonylamino)butanoate
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Formula C17H33NO4
InChI InChI=1S/C17H33NO4/c1-6-7-8-9-10-11-21-16(19)15(14(4)5)18-17(20)22-12-13(2)3/h13-15H,6-12H2,1-5H3,(H,18,20)
InChIKey RTVXYMUYSQCOIR-UHFFFAOYSA-N
Molecular Weight 315.454 g/mol
SMILES N(C(OCC(C)C)=O)C(C(OCCCCCCC)=O)C(C)C
SPLASH splash10-05fr-9500000000-933d12752b34ee494fdd
Source of Spectrum NP-10-9558-0
Wiley ID 1109283