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Dimethyl L-prolyl-L-aspartate

View entire compound with spectra: 1 NMR, and 1 FTIR

Dimethyl L-prolyl-L-aspartate
SpectraBase Compound ID HrZ27UlVfnN
InChI InChI=1S/C11H18N2O5/c1-17-9(14)6-8(11(16)18-2)13-10(15)7-4-3-5-12-7/h7-8,12H,3-6H2,1-2H3,(H,13,15)/t7-,8-/m0/s1
InChIKey YGSSVSZVGAEZMX-YUMQZZPRSA-N
Mol Weight 258.27 g/mol
Molecular Formula C11H18N2O5
Exact Mass 258.121572 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ETnD2XUjNKo
Name Dimethyl L-prolyl-L-aspartate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.121571683 u
Formula C11H18N2O5
InChI InChI=1S/C11H18N2O5/c1-17-9(14)6-8(11(16)18-2)13-10(15)7-4-3-5-12-7/h7-8,12H,3-6H2,1-2H3,(H,13,15)/t7-,8-/m0/s1
InChIKey YGSSVSZVGAEZMX-YUMQZZPRSA-N
Molecular Weight 258.274 g/mol
SMILES C([C@@](NC([C@]1(NCCC1)[H])=O)(CC(=O)OC)[H])(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.964941