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2-[5-Diethylcarbamoyl-4-methyl-1H-1-imidazolyl]malonic acid dimethyl ester
SpectraBase Compound ID 54E5U1WWy93
InChI InChI=1S/C14H21N3O5/c1-6-16(7-2)12(18)10-9(3)15-8-17(10)11(13(19)21-4)14(20)22-5/h8,11H,6-7H2,1-5H3
InChIKey ZCGVWERCAPOXST-UHFFFAOYSA-N
Mol Weight 311.34 g/mol
Molecular Formula C14H21N3O5
Exact Mass 311.148121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BEVxFFglU
Name 2-[5-Diethylcarbamoyl-4-methyl-1H-1-imidazolyl]malonic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21N3O5
InChI InChI=1S/C14H21N3O5/c1-6-16(7-2)12(18)10-9(3)15-8-17(10)11(13(19)21-4)14(20)22-5/h8,11H,6-7H2,1-5H3
InChIKey ZCGVWERCAPOXST-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol701522t
Molecular Weight 311.338 g/mol
SMILES c1(C(N(CC)CC)=O)c(C)nc[n]1C(C(OC)=O)C(OC)=O
SPLASH splash10-03dj-0492000000-c621ecc8708c25c89c44
Source of Spectrum A1-9-3461/SMS10-4g
Synonyms Dimethyl 2-(5-(diethylcarbamoyl)-4-methyl-1H-imidazol-1-yl)malonate 2-[5-[diethylamino(oxo)methyl]-4-methyl-1-imidazolyl]propanedioic acid dimethyl ester Dimethyl 2-[5-(diethylcarbamoyl)-4-methylimidazol-1-yl]propanedioate Dimethyl 2-[5-(diethylcarbamoyl)-4-methyl-imidazol-1-yl]propanedioate
Wiley ID 1758565