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3-Hexen-2-one, (5S)-5-[(t-butoxycarbonyl-(R)-alanyl)amino]-6-phenyl-
SpectraBase Compound ID Ju8ag7EVBLY
InChI InChI=1S/C20H28N2O4/c1-14(23)11-12-17(13-16-9-7-6-8-10-16)22-18(24)15(2)21-19(25)26-20(3,4)5/h6-12,15,17H,13H2,1-5H3,(H,21,25)(H,22,24)/b12-11+
InChIKey MQSLTLWMBMPXMH-VAWYXSNFSA-N
Mol Weight 360.45 g/mol
Molecular Formula C20H28N2O4
Exact Mass 360.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGxPd7SMD3z
Name 3-HEXEN-2-ONE, (5S)-5-[(tert-BUTYLOXYCARBONYL-(R)-ALANYL)AMINO]-6-PHENYL-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H28N2O4
InChI InChI=1S/C20H28N2O4/c1-14(23)11-12-17(13-16-9-7-6-8-10-16)22-18(24)15(2)21-19(25)26-20(3,4)5/h6-12,15,17H,13H2,1-5H3,(H,21,25)(H,22,24)/b12-11+
InChIKey MQSLTLWMBMPXMH-VAWYXSNFSA-N
Instrument Name 311A
Molecular Weight 360.2042
SMILES N(C(C(NC(\C=C\C(C)=O)Cc1ccccc1)=O)C)C(=O)OC(C)(C)C
SPLASH splash10-052e-9210000000-6246305ae12abd125e56
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany