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METHYLSUCCINIC ACID, 1-BUTYL ESTER

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METHYLSUCCINIC ACID, 1-BUTYL ESTER
SpectraBase Compound ID 9B26Orrt4r9
InChI InChI=1S/C9H16O4/c1-3-4-5-13-9(12)7(2)6-8(10)11/h7H,3-6H2,1-2H3,(H,10,11)
InChIKey OOOSEAAWXJSCTH-UHFFFAOYSA-N
Mol Weight 188.22 g/mol
Molecular Formula C9H16O4
Exact Mass 188.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HiQtRdZQZCV
Name Butyl 2-methyl-succinate
CAS Registry Number 67534-58-1
Comments XL-100 OR PS-100
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C9H16O4
InChI InChI=1S/C9H16O4/c1-3-4-5-13-9(12)7(2)6-8(10)11/h7H,3-6H2,1-2H3,(H,10,11)
InChIKey OOOSEAAWXJSCTH-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference L.V. Yerino, M.E. Osborn, P.S. Mariano, Tetrahedron 38, 1579 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3