Debug Info

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_id
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FDXroInHYBu
spectrumID
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FDXroInHYBu
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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O7-(2-ACETOXYETHYL)-O1-METHYL-(3E)-5-METHYL-3-HEPTENEDIOATE
SpectraBase Compound ID 17Z0foeqKFt
InChI InChI=1S/C13H20O6/c1-10(5-4-6-12(15)17-3)9-13(16)19-8-7-18-11(2)14/h4-5,10H,6-9H2,1-3H3/b5-4+
InChIKey IEFFYWOOXWCJSV-SNAWJCMRSA-N
Mol Weight 272.3 g/mol
Molecular Formula C13H20O6
Exact Mass 272.125988 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FDXroInHYBu
Name O7-(2-ACETOXYETHYL)-O1-METHYL-(3E)-5-METHYL-3-HEPTENEDIOATE
CAS Registry Number 127281-11-2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O6
InChI InChI=1S/C13H20O6/c1-10(5-4-6-12(15)17-3)9-13(16)19-8-7-18-11(2)14/h4-5,10H,6-9H2,1-3H3/b5-4+
InChIKey IEFFYWOOXWCJSV-SNAWJCMRSA-N
Literature Reference Author U.GRUSECK,M.HEUSCHMANN
Literature Reference Citation CHEM.BER.,123,1911(1990)
Literature Reference DOI 10.1002/cber.19901230925
Molecular Weight 272.298 g/mol
Solvent CDCl3
Source File Reference UWED10428
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