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1-Hexyn-1-ol, 4-nitrobenzoate

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1-Hexyn-1-ol, 4-nitrobenzoate
SpectraBase Compound ID LT0tkEyOrXp
InChI InChI=1S/C13H13NO4/c1-2-3-4-5-10-18-13(15)11-6-8-12(9-7-11)14(16)17/h6-9H,2-4H2,1H3
InChIKey NRNOAFLUUSJIIR-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IKKpgRwVJPP
Name 4-Nitro-benzoic acid, 1-hexynyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-2-3-4-5-10-18-13(15)11-6-8-12(9-7-11)14(16)17/h6-9H,2-4H2,1H3
InChIKey NRNOAFLUUSJIIR-UHFFFAOYSA-N
Instrument Name Varian XL-300
Literature Reference P.J. Stang, M. Boeshar, H. Wingert, J. Am. Chem. Soc. 110, 3272 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3