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Hexanedioic acid, 2,5-diethyl-, dimethyl ester
SpectraBase Compound ID BPyAjk1hizT
InChI InChI=1S/C12H22O4/c1-5-9(11(13)15-3)7-8-10(6-2)12(14)16-4/h9-10H,5-8H2,1-4H3
InChIKey MHQZDNUNANBSDM-UHFFFAOYSA-N
Mol Weight 230.3 g/mol
Molecular Formula C12H22O4
Exact Mass 230.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HB3TXLZnkFz
Name Hexanedioic acid, 2,5-diethyl-, dimethyl ester
Alternate Name(s) Dimethyl 2,5-diethylhexanedioate 2,5-Diethyladipic acid dimethyl ester 2,5-Diethylhexanedioic acid dimethyl ester Dimethyl-2,5-diethyladipate
CAS Registry Number 55191-18-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-5-9(11(13)15-3)7-8-10(6-2)12(14)16-4/h9-10H,5-8H2,1-4H3
InChIKey MHQZDNUNANBSDM-UHFFFAOYSA-N
Molecular Weight 230.304 g/mol
SMILES C(OC)(C(CC)CCC(C(OC)=O)CC)=O
SPLASH splash10-1009-9700000000-39bb24b30a65656734c5
Source of Spectrum AD-0-4022-0
Wiley ID 30853