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2-Undecynoic acid methyl ester

View entire compound with spectra: 5 NMR, 1 FTIR, and 1 MS (GC)

2-Undecynoic acid methyl ester
SpectraBase Compound ID Fyd5rbc90jG
InChI InChI=1S/C12H20O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3-9H2,1-2H3
InChIKey YPUZOJRRZPRXNV-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IlBwBxcQ1Ar
Name 2-Undecynoic acid, methyl ester
CAS Registry Number 10522-18-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3-9H2,1-2H3
InChIKey YPUZOJRRZPRXNV-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference J. Bus, I. Sies, M. Lie Ken Jie, Chem. Phys. Lipids 17, 501 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3