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2-Acetyl-2-methyl-adipic acid diethyl ester
SpectraBase Compound ID LOnVjybLOlr
InChI InChI=1S/C13H22O5/c1-5-17-11(15)8-7-9-13(4,10(3)14)12(16)18-6-2/h5-9H2,1-4H3
InChIKey JBBOMOCSPGZBIM-UHFFFAOYSA-N
Mol Weight 258.31 g/mol
Molecular Formula C13H22O5
Exact Mass 258.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7OcxDZJTzCY
Name 2-Acetyl-2-methyl-adipic acid diethyl ester
Alternate Name(s) 2-Acetyl-2-methylhexanedioic acid diethyl ester Diethyl 2-acetyl-2-methyl-hexanedioate Diethyl 2-ethanoyl-2-methyl-hexanedioate
CAS Registry Number 73087-75-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O5
InChI InChI=1S/C13H22O5/c1-5-17-11(15)8-7-9-13(4,10(3)14)12(16)18-6-2/h5-9H2,1-4H3
InChIKey JBBOMOCSPGZBIM-UHFFFAOYSA-N
Molecular Weight 258.314 g/mol
SMILES C(C(=O)OCC)(C(=O)C)(CCCC(=O)OCC)C
SPLASH splash10-0006-9400000000-a0b8ddc41d17fc974965
Source of Spectrum K-113-454-0
Wiley ID 1261553