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4-ETHYL-7,7-DIMETHYL-3,4,5,6,7,8-HEXAHYDROBENZOPYRANE-2(H),5-DIONE
SpectraBase Compound ID LBH4Qzo14a3
InChI InChI=1S/C13H18O3/c1-4-8-5-11(15)16-10-7-13(2,3)6-9(14)12(8)10/h8H,4-7H2,1-3H3/t8-/m0/s1
InChIKey RFRDVXKIBHPGJU-QMMMGPOBSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8SDFAaQAtri
Name 4-ETHYL-7,7-DIMETHYL-3,4,5,6,7,8-HEXAHYDROBENZOPYRANE-2(H),5-DIONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-4-8-5-11(15)16-10-7-13(2,3)6-9(14)12(8)10/h8H,4-7H2,1-3H3/t8-/m0/s1
InChIKey RFRDVXKIBHPGJU-QMMMGPOBSA-N
Literature Reference Author K.ITOH,M.HASEGAWA,J.TANAKA,S.KANEMASA
Literature Reference Citation ORG.LETTERS,7,979(2005)
Literature Reference DOI 10.1021/ol047872g
Molecular Weight 222.284 g/mol
Sample ID 42496
Solvent CDCl3