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2,2-Dimethyl-[1,3]dioxolane-4,5-dicarboxylic acid, di-t-butyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

2,2-Dimethyl-[1,3]dioxolane-4,5-dicarboxylic acid, di-t-butyl ester
SpectraBase Compound ID 94JDZMmnPzg
InChI InChI=1S/C15H26O6/c1-13(2,3)20-11(16)9-10(19-15(7,8)18-9)12(17)21-14(4,5)6/h9-10H,1-8H3
InChIKey RZTNLDABBBZIHU-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C15H26O6
Exact Mass 302.172939 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H5at6YDclj1
Name 2,2-Dimethyl-[1,3]dioxolane-4,5-dicarboxylic acid, di-T-butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.172938551 u
Formula C15H26O6
InChI InChI=1S/C15H26O6/c1-13(2,3)20-11(16)9-10(19-15(7,8)18-9)12(17)21-14(4,5)6/h9-10H,1-8H3
InChIKey RZTNLDABBBZIHU-UHFFFAOYSA-N
SMILES CC1(C)OC(C(=O)OC(C)(C)C)C(O1)C(=O)OC(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.87511