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Dimethyl (5R,6R)-1,4,5,6-tetrahydro-6-phenyl-pyridine-2,5-dicarboxylate

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

Dimethyl (5R,6R)-1,4,5,6-tetrahydro-6-phenyl-pyridine-2,5-dicarboxylate
SpectraBase Compound ID CEHKDByAcUk
InChI InChI=1S/C15H17NO4/c1-19-14(17)11-8-9-12(15(18)20-2)16-13(11)10-6-4-3-5-7-10/h3-7,9,11,13,16H,8H2,1-2H3/t11-,13+/m1/s1
InChIKey DHNZAZKIPGPEDS-YPMHNXCESA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IzY6Vp8sPRK
Name Dimethyl (5R,6R)-1,4,5,6-tetrahydro-6-phenyl-pyridine-2,5-dicarboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.115758027 u
Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-19-14(17)11-8-9-12(15(18)20-2)16-13(11)10-6-4-3-5-7-10/h3-7,9,11,13,16H,8H2,1-2H3/t11-,13+/m1/s1
InChIKey DHNZAZKIPGPEDS-YPMHNXCESA-N
SMILES [C@@]1(NC(=CC[C@]1(C(=O)OC)[H])C(=O)OC)(C=1C=CC=CC1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927725