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2-Ethyl 7-Methyl 1-benzyl-9-oxo-1-azacycloundec-4-ene-2,7-dicarboxylate
SpectraBase Compound ID K8qlPc4PZLG
InChI InChI=1S/C22H29NO5/c1-3-28-22(26)20-12-8-7-11-18(21(25)27-2)15-19(24)13-14-23(20)16-17-9-5-4-6-10-17/h4-10,18,20H,3,11-16H2,1-2H3/b8-7-
InChIKey MHHRVQJMCHXKDR-FPLPWBNLSA-N
Mol Weight 387.48 g/mol
Molecular Formula C22H29NO5
Exact Mass 387.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFJFWUSXiqw
Name 2-Ethyl 7-Methyl 1-benzyl-9-oxo-1-azacycloundec-4-ene-2,7-dicarboxylate
Alternate Name(s) 2-Ethyl 7-Methyl 1-benzyl-9-oxo-7-azacycloundec-4-ene-2,7-dicarboxylate 2-Ethyl 7-methyl 1-benzyl-9-oxoazacycloundec-4-ene-2,7-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO5
InChI InChI=1S/C22H29NO5/c1-3-28-22(26)20-12-8-7-11-18(21(25)27-2)15-19(24)13-14-23(20)16-17-9-5-4-6-10-17/h4-10,18,20H,3,11-16H2,1-2H3/b8-7-
InChIKey MHHRVQJMCHXKDR-FPLPWBNLSA-N
Molecular Weight 387.476 g/mol
SMILES C1(N(CCC(CC(C\C=C/C1)C(=O)OC)=O)Cc1ccccc1)C(=O)OCC
SPLASH splash10-0006-9003000000-3ae9e0979450d35181f9
Source of Spectrum K1-2001-4204-32
Wiley ID 813565