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3-Benzyl-6-iso-propyl-2,5-piperazinedione

View entire compound with spectra: 1 NMR, and 7 MS (GC)

3-Benzyl-6-iso-propyl-2,5-piperazinedione
SpectraBase Compound ID JNN8JcpvRhA
InChI InChI=1S/C14H18N2O2/c1-9(2)12-14(18)15-11(13(17)16-12)8-10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3,(H,15,18)(H,16,17)
InChIKey OQQPOHUVAQPSHJ-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C14H18N2O2
Exact Mass 246.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L9LA26Bn5uq
Name Cyclo-L-phenylalanyl-valin
CAS Registry Number 55904-04-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H18N2O2
InChI InChI=1S/C14H18N2O2/c1-9(2)12-14(18)15-11(13(17)16-12)8-10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3,(H,15,18)(H,16,17)
InChIKey OQQPOHUVAQPSHJ-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference R. Deslauriers, Z. Grzonka, K. Schaumburg, J. Am. Chem. Soc. 97, 5093 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO