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2-[(3aS,7S,7aR)-7-hydroxy-2,2,4-trimethyl-6-methylene-3,3a,7,7a-tetrahydro-1H-inden-5-yl]-2-keto-acetic acid methyl ester

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2-[(3aS,7S,7aR)-7-hydroxy-2,2,4-trimethyl-6-methylene-3,3a,7,7a-tetrahydro-1H-inden-5-yl]-2-keto-acetic acid methyl ester
SpectraBase Compound ID EhJfvpRnAC7
InChI InChI=1S/C16H22O4/c1-8-10-6-16(3,4)7-11(10)13(17)9(2)12(8)14(18)15(19)20-5/h10-11,13,17H,2,6-7H2,1,3-5H3/t10-,11-,13-/m1/s1
InChIKey WHJOGHGMIOFLTE-NQBHXWOUSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bx6Da5AfLQ7
Name 2-[(3aS,7S,7aR)-7-hydroxy-2,2,4-trimethyl-6-methylene-3,3a,7,7a-tetrahydro-1H-inden-5-yl]-2-keto-acetic acid methyl ester
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-8-10-6-16(3,4)7-11(10)13(17)9(2)12(8)14(18)15(19)20-5/h10-11,13,17H,2,6-7H2,1,3-5H3/t10-,11-,13-/m1/s1
InChIKey WHJOGHGMIOFLTE-NQBHXWOUSA-N
Literature Reference Author A.ARNONE,C.DEGREGORIO,G.NASINI,O.V.DEPAVA
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1523(1997)
Literature Reference DOI 10.1039/a608174f
Molecular Weight 278.348 g/mol
Solvent CDCl3
Source File Reference UWRU10002