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4-N-(p-Methoxybenzyl)-1-ethyl-(cis)-2,3-epoxysuccinamate

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

4-N-(p-Methoxybenzyl)-1-ethyl-(cis)-2,3-epoxysuccinamate
SpectraBase Compound ID 6RwQzzBfBQs
InChI InChI=1S/C14H17NO5/c1-3-19-14(17)12-11(20-12)13(16)15-8-9-4-6-10(18-2)7-5-9/h4-7,11-12H,3,8H2,1-2H3,(H,15,16)/t11-,12+/m0/s1
InChIKey XPVRJTWDOVNHIF-NWDGAFQWSA-N
Mol Weight 279.29 g/mol
Molecular Formula C14H17NO5
Exact Mass 279.110673 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BD1LJiSc0HX
Name 4-N-(p-Methoxybenzyl)-1-ethyl-(cis)-2,3-epoxysuccinamate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.110672646 u
Formula C14H17NO5
InChI InChI=1S/C14H17NO5/c1-3-19-14(17)12-11(20-12)13(16)15-8-9-4-6-10(18-2)7-5-9/h4-7,11-12H,3,8H2,1-2H3,(H,15,16)/t11-,12+/m0/s1
InChIKey XPVRJTWDOVNHIF-NWDGAFQWSA-N
SMILES [C@@]1([C@](C(=O)OCC)(O1)[H])(C(NCC=1C=CC(=CC1)OC)=O)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968695