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D-Prolyl-D-proline, N-propargyloxycarbonyl-, isobutyl ester

View entire compound with spectra: 1 NMR

D-Prolyl-D-proline, N-propargyloxycarbonyl-, isobutyl ester
SpectraBase Compound ID 8EgQs7DfrYf
InChI InChI=1S/C18H26N2O5/c1-4-11-24-18(23)20-10-5-7-14(20)16(21)19-9-6-8-15(19)17(22)25-12-13(2)3/h1,13-15H,5-12H2,2-3H3
InChIKey DQNMYIIETVSOJJ-UHFFFAOYSA-N
Mol Weight 350.42 g/mol
Molecular Formula C18H26N2O5
Exact Mass 350.184172 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 49qQxinH413
Name D-Prolyl-D-proline, N-propargyloxycarbonyl-, isobutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 350.184171940 u
Formula C18H26N2O5
InChI InChI=1S/C18H26N2O5/c1-4-11-24-18(23)20-10-5-7-14(20)16(21)19-9-6-8-15(19)17(22)25-12-13(2)3/h1,13-15H,5-12H2,2-3H3
InChIKey DQNMYIIETVSOJJ-UHFFFAOYSA-N
Molecular Weight 350.415 g/mol
SMILES C1(N(CCC1)C(C1CCCN1C(OCC#C)=O)=O)C(OCC(C)C)=O