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l-Isoleucine, N-isobutoxycarbonyl-, isohexyl ester
SpectraBase Compound ID 7jRPUeSTuyP
InChI InChI=1S/C17H33NO4/c1-7-14(6)15(18-17(20)22-11-13(4)5)16(19)21-10-8-9-12(2)3/h12-15H,7-11H2,1-6H3,(H,18,20)
InChIKey AJPIYIAGUFTNFJ-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 Bw89QblYo82
Name l-Isoleucine, N-isobutoxycarbonyl-, isohexyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H33NO4
InChI InChI=1S/C17H33NO4/c1-7-14(6)15(18-17(20)22-11-13(4)5)16(19)21-10-8-9-12(2)3/h12-15H,7-11H2,1-6H3,(H,18,20)
InChIKey AJPIYIAGUFTNFJ-UHFFFAOYSA-N
Molecular Weight 315.454 g/mol
SMILES N(C(OCC(C)C)=O)C(C(CC)C)C(OCCCC(C)C)=O
SPLASH splash10-000i-8900000000-91853b216e15d84ef936
Source of Spectrum NP-10-9556-0
Synonyms 3-Methyl-2-[[2-methylpropoxy(oxo)methyl]amino]pentanoic acid 4-methylpentyl ester isohexyl 2-(isobutoxycarbonylamino)-3-methyl-pentanoate 4-Methylpentyl 3-methyl-2-(2-methylpropoxycarbonylamino)pentanoate
Wiley ID 1109281