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2,5-Dimethyl-1-ureido-4,5,6,7-tetrahydro-1H-indole-3,7-dicarboxylic acid dimethyl ester
SpectraBase Compound ID HsJmLnaz4PY
InChI InChI=1S/C15H21N3O5/c1-7-5-9-11(14(20)23-4)8(2)18(17-15(16)21)12(9)10(6-7)13(19)22-3/h7,10H,5-6H2,1-4H3,(H3,16,17,21)
InChIKey BDQKJETZGZEHFZ-UHFFFAOYSA-N
Mol Weight 323.35 g/mol
Molecular Formula C15H21N3O5
Exact Mass 323.148121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYQ0bVsC28x
Name 2,5-Dimethyl-1-ureido-4,5,6,7-tetrahydro-1H-indole-3,7-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 2,5-dimethyl-1-ureido-4,5,6,7-tetrahydro-1H-indole-3,7-dicarboxylate
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Formula C15H21N3O5
InChI InChI=1S/C15H21N3O5/c1-7-5-9-11(14(20)23-4)8(2)18(17-15(16)21)12(9)10(6-7)13(19)22-3/h7,10H,5-6H2,1-4H3,(H3,16,17,21)
InChIKey BDQKJETZGZEHFZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200800097
Molecular Weight 323.349 g/mol
SMILES N(C(=O)N)[n]1c(c(c2CC(CC(c12)C(=O)OC)C)C(=O)OC)C
SPLASH splash10-03di-0190000000-ea7876c51a4a3e7f4ec2
Source of Spectrum ASC-350-1331/SM19-3ae
Wiley ID 1766347