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Spectral Data   Additional Data   Download  
Molecule
89963
Chemical name(s)DEAMA; diethyl acetamidomalonic acid; diethyl acetamidomalonic acid, 2-(13)C-labeled; diethylacetamidomalonate; diethylacetamidomalonic acid
Chemical formulaC9H15NO5
Molecular weight217.219
Number of double bond equivalents (DBEs)3.0
Number of all rings, size of smallest set of smallest rings0, 0
Canonical name(s)
CAS-Number 1068-90-2
Additional information
Links from Unichem:
Molecule keywords
DOI
13C Spectrum
60006820 Rating: 10 (10: nmrshiftdb2 quality check: 10 (accept)/reliability: excellent (admin))
Type13C
Measurement conditions
Temperature [K]Unreported
SolventUnreported
Field Strength [MHz]Unreported
Assignment MethodUnreported
Literature
Additional comments11924.MOL.2; /* changed */ C-2, (C-4,C-5) reversed
nmrshiftdb2 quality report Download
Additional information
Spectrum categoriesocmainz inhouse-2



Spectral Data   Additional Data   Download  
Type: 13C 150.0
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
expt-0
ocmainz inhouse-2
1 S 166.4190 166.6
1" T 62.5617 62.5
1' T 62.5617 62.5
2 D 56.3887 56.6
2" Q 13.9480 14.0
2' Q 13.9480 14.0
3 S 166.4190 166.6
5 S 169.8350 170.0
6 Q 22.6891 22.5






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