2-[1-(4-Methyl-1-piperazinyl)cyclopropyl]propanedioic acid diethyl ester

SpectraBase Compound ID	Fmtc1GuVURq
InChI	InChI=1S/C15H26N2O4/c1-4-20-13(18)12(14(19)21-5-2)15(6-7-15)17-10-8-16(3)9-11-17/h12H,4-11H2,1-3H3
InChIKey	YWQIAPOVIKETSB-UHFFFAOYSA-N Google Search
Mol Weight	298.38 g/mol
Molecular Formula	C15H26N2O4
Exact Mass	298.189257 g/mol

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SpectraBase Spectrum ID	5wQnY8yVbab
Name	2-[1-(4-Methyl-1-piperazinyl)cyclopropyl]propanedioic acid diethyl ester
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	298.189257321 u
Formula	C15H26N2O4
InChI	InChI=1S/C15H26N2O4/c1-4-20-13(18)12(14(19)21-5-2)15(6-7-15)17-10-8-16(3)9-11-17/h12H,4-11H2,1-3H3
InChIKey	YWQIAPOVIKETSB-UHFFFAOYSA-N
Molecular Weight	298.383 g/mol
SMILES	C(C(C(=O)OCC)C1(CC1)N1CCN(CC1)C)(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR)	0.97859