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3-Hydroxy-4-methyl-4-pentenoic acid, isopropyl ester
SpectraBase Compound ID ChuW0HWwe3f
InChI InChI=1S/C9H16O3/c1-6(2)8(10)5-9(11)12-7(3)4/h7-8,10H,1,5H2,2-4H3
InChIKey HIHORGXBUMLUTQ-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wqLeesgFh0
Name 3-Hydroxy-4-methyl-4-pentenoic acid, isopropyl ester
CAS Registry Number 94621-15-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-6(2)8(10)5-9(11)12-7(3)4/h7-8,10H,1,5H2,2-4H3
InChIKey HIHORGXBUMLUTQ-UHFFFAOYSA-N
Instrument Name Bruker AM-500
Literature Reference R.L. Halterman, N.H. Nguyen, K. Vollhardt, J. Am. Chem. Soc. 107, 1379 (1985).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3