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trans-2-PENTEN-4-YNOIC ACID, METHYL ESTER
SpectraBase Compound ID 2KQSZstOX7m
InChI InChI=1S/C6H6O2/c1-3-4-5-6(7)8-2/h1,4-5H,2H3/b5-4+
InChIKey AHMIYBXPGOFGQT-SNAWJCMRSA-N
Mol Weight 110.11 g/mol
Molecular Formula C6H6O2
Exact Mass 110.036779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2PHo2GLhba
Name trans-Pent-2-en-4-yn-oic acid, methyl ester
CAS Registry Number 41345-43-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6O2
InChI InChI=1S/C6H6O2/c1-3-4-5-6(7)8-2/h1,4-5H,2H3/b5-4+
InChIKey AHMIYBXPGOFGQT-SNAWJCMRSA-N
Instrument Name Bruker HX-90
Literature Reference M.T. Hearn, J.L. Turner, J. Chem. Soc. Perkin II 1027 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3