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1-Tert-butyl-2-methyl-2-(tert-butoxymethyl)-5-oxopyrrolidine-1,2-dicarboxylate
SpectraBase Compound ID aSSz8DMnfi
InChI InChI=1S/C16H27NO6/c1-14(2,3)22-10-16(12(19)21-7)9-8-11(18)17(16)13(20)23-15(4,5)6/h8-10H2,1-7H3/t16-/m0/s1
InChIKey RFVSFXIZNLHVSZ-INIZCTEOSA-N
Mol Weight 329.39 g/mol
Molecular Formula C16H27NO6
Exact Mass 329.183838 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ad2ipCsqY3r
Name 1-Tert-butyl-2-methyl-2-(tert-butoxymethyl)-5-oxopyrrolidine-1,2-dicarboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.183837587 u
Formula C16H27NO6
InChI InChI=1S/C16H27NO6/c1-14(2,3)22-10-16(12(19)21-7)9-8-11(18)17(16)13(20)23-15(4,5)6/h8-10H2,1-7H3/t16-/m0/s1
InChIKey RFVSFXIZNLHVSZ-INIZCTEOSA-N
Molecular Weight 329.393 g/mol
SMILES [C@]1(CCC(N1C(=O)OC(C)(C)C)=O)(C(OC)=O)COC(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.814362