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3-Hydroxy-2-methyl-1,3-hexadien-5-one
SpectraBase Compound ID 6jS3OIZ7357
InChI InChI=1S/C7H10O2/c1-5(2)7(9)4-6(3)8/h4,9H,1H2,2-3H3/b7-4-
InChIKey YBJRBTOUVLEOEZ-DAXSKMNVSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5nuRLUTeRSG
Name 1-ISOPROPENYL-1,3-BUTANDIONE
Comments C
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-5(2)7(9)4-6(3)8/h4,9H,1H2,2-3H3/b7-4-
InChIKey YBJRBTOUVLEOEZ-DAXSKMNVSA-N
Instrument Name Bruker HX-90
Literature Reference A.I.KOLTSOV, YU.A.IGNAT'EV, V.V.KOPEIKIN, E.F.PANARIN (1976)Zhurn.Org.Khim.(Russ. Lang.): v.12, N9, 2036-2037.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d