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4-METHYLADIPALDEHYDIC ACID, METHYL ESTER
SpectraBase Compound ID L09kMsLW4Hc
InChI InChI=1S/C8H14O3/c1-7(5-6-9)3-4-8(10)11-2/h6-7H,3-5H2,1-2H3
InChIKey GLWKKPUBEBUMRT-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I4fWUar0vCy
Name 4-METHYLADIPALDEHYDIC ACID, METHYL ESTER
Source of Sample A. Hardt, W. Bremser BASF Ludwigshafen (1983)
CAS Registry Number 76712-35-1
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-7(5-6-9)3-4-8(10)11-2/h6-7H,3-5H2,1-2H3
InChIKey GLWKKPUBEBUMRT-UHFFFAOYSA-N
Molecular Weight 158.20
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WM-360
Synonyms VALERIC ACID, 5-FORMYL-4-METHYL-, METHYL ESTER ADIPALDEHYDIC ACID, 4-METHYL-, METHYL ESTER