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Methyl 5,5-dimethoxypentanoate

View entire compound with spectra: 2 NMR, 3 FTIR, and 2 MS (GC)

Methyl 5,5-dimethoxypentanoate
SpectraBase Compound ID 3g01RtVWneI
InChI InChI=1S/C8H16O4/c1-10-7(9)5-4-6-8(11-2)12-3/h8H,4-6H2,1-3H3
InChIKey YOFAONQHOIRLCQ-UHFFFAOYSA-N
Mol Weight 176.21 g/mol
Molecular Formula C8H16O4
Exact Mass 176.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5CMPN2Blppe
Name Methyl 5,5-dimethoxyvalerate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 405817
CAS Registry Number 23068-91-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O4
InChI InChI=1S/C8H16O4/c1-10-7(9)5-4-6-8(11-2)12-3/h8H,4-6H2,1-3H3
InChIKey YOFAONQHOIRLCQ-UHFFFAOYSA-N
Observed nucleus 13C
Purity 96%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Methyl 5,5-dimethoxypentanoate 5,5-Dimethoxyvaleric acid methyl ester
Wiley ID SIAL_13CNMR_008895