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Propanedioic acid, [2,3,4,5-tetrahydro-6-(methoxycarbonyl)-7-methyl-2-oxo-1H-1,3-diazepi n-4-yl]-, diethyl ester
SpectraBase Compound ID 5QywgVIZ5cv
InChI InChI=1S/C15H22N2O7/c1-5-23-13(19)11(14(20)24-6-2)10-7-9(12(18)22-4)8(3)16-15(21)17-10/h10-11H,5-7H2,1-4H3,(H2,16,17,21)
InChIKey PYHYJVRYSVVRFI-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C15H22N2O7
Exact Mass 342.142701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzCAlnbDz10
Name Propanedioic acid, [2,3,4,5-tetrahydro-6-(methoxycarbonyl)-7-methyl-2-oxo-1H-1,3-diazepi n-4-yl]-, diethyl ester
Alternate Name(s) 1H-1,3-diazepine, propanedioic acid deriv. Diethyl 2-[6-(methoxycarbonyl)-7-methyl-2-oxo-2,3,4,5-tetrahydro-1H-1,3-diazepin-4-yl]malonate Methyl 7-diethoxycarbonylmethyl-2,3,6,7-tetrahydro-4-methyl-2-oxo-1H-1,3-diazepine-5-carboxylater
CAS Registry Number 64613-03-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22N2O7
InChI InChI=1S/C15H22N2O7/c1-5-23-13(19)11(14(20)24-6-2)10-7-9(12(18)22-4)8(3)16-15(21)17-10/h10-11H,5-7H2,1-4H3,(H2,16,17,21)
InChIKey PYHYJVRYSVVRFI-UHFFFAOYSA-N
Molecular Weight 342.348 g/mol
SMILES N1C(=C(CC(NC1=O)C(C(=O)OCC)C(=O)OCC)C(=O)OC)C
SPLASH splash10-001l-2900000000-7ded45a573848a4469fa
Source of Spectrum I-55-904-0
Wiley ID 1336294