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2-(E)-Pentenoic acid, (4S)-4-[(t-butoxycarbonyl-(R)-alanyl)amino]-, ethyl ester
SpectraBase Compound ID DpMFzJNerIw
InChI InChI=1S/C15H26N2O5/c1-7-21-12(18)9-8-10(2)16-13(19)11(3)17-14(20)22-15(4,5)6/h8-11H,7H2,1-6H3,(H,16,19)(H,17,20)/b9-8+
InChIKey MHKCUBUWBNTLIX-CMDGGOBGSA-N
Mol Weight 314.38 g/mol
Molecular Formula C15H26N2O5
Exact Mass 314.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFdic26mKjz
Name 2-(E)-PENTENOIC ACID, (4S)-4-[(tert-BUTYLOXYCARBONYL-(S)-ALANYL)AMINO]-, ETHYL ESTER
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Formula C15H26N2O5
InChI InChI=1S/C15H26N2O5/c1-7-21-12(18)9-8-10(2)16-13(19)11(3)17-14(20)22-15(4,5)6/h8-11H,7H2,1-6H3,(H,16,19)(H,17,20)/b9-8+
InChIKey MHKCUBUWBNTLIX-CMDGGOBGSA-N
Instrument Name 311A
Molecular Weight 314.1835
SMILES N(C(C(NC(C)\C=C\C(=O)OCC)=O)C)C(=O)OC(C)(C)C
SPLASH splash10-0006-9200000000-cb0520f98d1f4d8729ba
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany