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7-Isopropyl-4,10-dimethyl-1,5-dioxa-spiro(5.5)undec-3-ene-2-one, isomer A

View entire compound with spectra: 1 NMR

7-Isopropyl-4,10-dimethyl-1,5-dioxa-spiro(5.5)undec-3-ene-2-one, isomer A
SpectraBase Compound ID Iw3VOXy7u7d
InChI InChI=1S/C14H22O3/c1-9(2)12-6-5-10(3)8-14(12)16-11(4)7-13(15)17-14/h7,9-10,12H,5-6,8H2,1-4H3/t10-,12+,14+/m1/s1
InChIKey WEUGLSGCWUMGED-OSMZGAPFSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CY91LQsNW65
Name 7-Isopropyl-4,10-dimethyl-1,5-dioxa-spiro(5.5)undec-3-ene-2-one, isomer A
Comments REL.-(5S,6S,9R)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-9(2)12-6-5-10(3)8-14(12)16-11(4)7-13(15)17-14/h7,9-10,12H,5-6,8H2,1-4H3/t10-,12+,14+/m1/s1
InChIKey WEUGLSGCWUMGED-OSMZGAPFSA-N
Instrument Name Bruker WH-400
Literature Reference M. Demuth, A. Palomer, H.D. Sluma, Angew. Chem. 98, 1093 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3