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ethyl 2-{6-[2-(4-acetylphenyl)acetyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-en-3-yl}acetate
SpectraBase Compound ID ANhmIbl7NLf
InChI InChI=1S/C21H22N2O6/c1-3-28-16(25)10-23-11-21-9-8-15(29-21)17(18(21)20(23)27)19(26)22-14-6-4-13(5-7-14)12(2)24/h4-9,15,17-18H,3,10-11H2,1-2H3,(H,22,26)
InChIKey LEEGAMGSKLQPRO-UHFFFAOYSA-N
Mol Weight 398.42 g/mol
Molecular Formula C21H22N2O6
Exact Mass 398.147786 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IddjqZrlzmq
Name ethyl 2-{6-[2-(4-acetylphenyl)acetyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-en-3-yl}acetate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.147786430 u
Formula C21H22N2O6
InChI InChI=1S/C21H22N2O6/c1-3-28-16(25)10-23-11-21-9-8-15(29-21)17(18(21)20(23)27)19(26)22-14-6-4-13(5-7-14)12(2)24/h4-9,15,17-18H,3,10-11H2,1-2H3,(H,22,26)
InChIKey LEEGAMGSKLQPRO-UHFFFAOYSA-N
Molecular Weight 398.415 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8733
Solvent DMSO-d6
Source Vendor ID: NMR/12669068