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((4'S,5'S)-1-Benzyl-5-[4,5-bis(ethoxycarbonyl)-1,3-dioxolan-2-yl]-2-pyridone
SpectraBase Compound ID FC1nXJ3xuvo
InChI InChI=1S/C21H23NO7/c1-3-26-19(24)17-18(20(25)27-4-2)29-21(28-17)15-10-11-16(23)22(13-15)12-14-8-6-5-7-9-14/h5-11,13,17-18,21H,3-4,12H2,1-2H3
InChIKey KUPQANOFVDFFKW-UHFFFAOYSA-N
Mol Weight 401.42 g/mol
Molecular Formula C21H23NO7
Exact Mass 401.147452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rF4bnYHwWX
Name ((4'S,5'S)-1-Benzyl-5-[4,5-bis(ethoxycarbonyl)-1,3-dioxolan-2-yl]-2-pyridone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO7
InChI InChI=1S/C21H23NO7/c1-3-26-19(24)17-18(20(25)27-4-2)29-21(28-17)15-10-11-16(23)22(13-15)12-14-8-6-5-7-9-14/h5-11,13,17-18,21H,3-4,12H2,1-2H3
InChIKey KUPQANOFVDFFKW-UHFFFAOYSA-N
Molecular Weight 401.415 g/mol
SMILES C1(C(OC(C2=CN(Cc3ccccc3)C(C=C2)=O)O1)C(=O)OCC)C(=O)OCC
SPLASH splash10-0udi-0003900000-de31f2e2cf99bc77ac9c
Source of Spectrum PS-54-256-47
Wiley ID 805133