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3-Butyn-2-ol, 2-methyl-, benzoate
SpectraBase Compound ID Jk7tziEq0ok
InChI InChI=1S/C12H12O2/c1-4-12(2,3)14-11(13)10-8-6-5-7-9-10/h1,5-9H,2-3H3
InChIKey XTTQOGPZZADBJS-UHFFFAOYSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AzAkA9XnUF0
Name 3-METHYL-1-BUTYN-3-YL BENZOATE
Comments 4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H12O2
InChI InChI=1S/C12H12O2/c1-4-12(2,3)14-11(13)10-8-6-5-7-9-10/h1,5-9H,2-3H3
InChIKey XTTQOGPZZADBJS-UHFFFAOYSA-N
Instrument Name Tesla BS487
Literature Reference P.KUTSCHY, M.DZURILLA, L.KNIEZO, J.BERNAT, J.IMRICH, P.KRISTIAN, R.NADASKAY(1986) Coll.Czech.Chem.Comm.: v.51, N5, 1119-1126.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d