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Methyl cycloheptatriene-7-carboxylate

Compound with spectra: 3 NMR, and 1 MS (GC)

Methyl cycloheptatriene-7-carboxylate
SpectraBase Compound ID BnlsebZbk5d
InChI InChI=1S/C9H10O2/c1-11-9(10)8-6-4-2-3-5-7-8/h2-8H,1H3
InChIKey KBZSIBZTASZFGF-UHFFFAOYSA-N
Mol Weight 150.18 g/mol
Molecular Formula C9H10O2
Exact Mass 150.06808 g/mol

View Spectrum of Methyl cycloheptatriene-7-carboxylate

MS (GC) Spectrum
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Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS

View Spectrum of Methyl cycloheptatriene-7-carboxylate

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of Methyl cycloheptatriene-7-carboxylate

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of Methyl cycloheptatriene-7-carboxylate

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
  • KBZSIBZTASZFGF-UHFFFAOYSA-N
  • METHYL-[8-13C]-CYCLOHEPTA-2,4,6-TRIENECARBOXYLATE
  • methyl cyclohepta-2,4,6-triene-1-carboxylate
[8-13C]-CYCLOHEPTA-2,4,6-TRIENECARBOXYLIC-ACID
2,4,6-CYCLOHEPTATRIEN-1-YL-METHYL-KETONE
(3E,5E)-7-hydroxy-2-methyl-octa-3,5-dienoic acid methyl ester
METHYL-(3E)-2,5-DIMETHYLHEXA-3,5-DIENOATE
(E)-5-hydroxy-2-methyl-3-hexenoic acid methyl ester
2-Cyclopentene-1-carboxylic acid, methyl ester
(3E,5E)-2-methyl-7-oxidanyl-octa-3,5-dienoic acid
(Z)-ETHYL-2,5-DIMETHYL-3-HEXENOATE
(E)-ETHYL-2,5-DIMETHYL-3-HEXENOATE
(E)-3-(1-cyclohepta-2,4,6-trienyl)-2-propenoic acid methyl ester
Title Journal or Book Year
Biosynthetic Studies of ω-Cycloheptyl Fatty Acids in Alicyclobacillus cycloheptanicus. Formation of Cycloheptanecarboxylic Acid from Phenylacetic Acid The Journal of Organic Chemistry 1997
Precursors to carbon-13-labeled reactive intermediates: preparation and NMR characterization of two doubly labeled isomers of methyl cyclopropene-3-carboxylate The Journal of Organic Chemistry 1990

This compound is available in the following databases:

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