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lithium(1+) 4-(3,5-dioxocyclohex-1-en-1-yl)-4-oxobutanoate

View entire compound with spectra: 1 NMR

lithium(1+) 4-(3,5-dioxocyclohex-1-en-1-yl)-4-oxobutanoate
SpectraBase Compound ID 3iGu627DCdo
InChI InChI=1S/C7H7N3O5.Li/c11-4-1-3(9-7(15)10-4)6(14)8-2-5(12)13;/h1H,2H2,(H,8,14)(H,12,13)(H2,9,10,11,15);/q;+1/p-1
InChIKey APHQFZNOAOOGKR-UHFFFAOYSA-M
Mol Weight 219.08 g/mol
Molecular Formula C7H6LiN3O5
Exact Mass 219.046749 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3cyLRreQ7jw
Name lithium(1+) 4-(3,5-dioxocyclohex-1-en-1-yl)-4-oxobutanoate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.046748740 u
Formula C7H6LiN3O5
InChI InChI=1S/C7H7N3O5.Li/c11-4-1-3(9-7(15)10-4)6(14)8-2-5(12)13;/h1H,2H2,(H,8,14)(H,12,13)(H2,9,10,11,15);/q;+1/p-1
InChIKey APHQFZNOAOOGKR-UHFFFAOYSA-M
Molecular Weight 219.081 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17534
Solvent DMSO-d6
Source Vendor ID: NMR/11270809; Lab Info: UDN; Lab Number: UDN-0000005