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2',2'-DIMETHYLPROPIONIC-ACID-3-ACETOXY-6-BROMO-7A-METHYL-5-OXO-OCTAHYDRO-INDEN-1-YL-ESTER
SpectraBase Compound ID CEiSjlS0prQ
InChI InChI=1S/C17H25BrO5/c1-9(19)22-13-7-14(23-15(21)16(2,3)4)17(5)8-11(18)12(20)6-10(13)17/h10-11,13-14H,6-8H2,1-5H3/t10-,11?,13+,14+,17+/m1/s1
InChIKey SYQSRXBAJYBJKJ-TXHGIBGJSA-N
Mol Weight 389.29 g/mol
Molecular Formula C17H25BrO5
Exact Mass 388.088537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HbQ9yQ7ldH8
Name 2',2'-DIMETHYLPROPIONIC-ACID-3-ACETOXY-6-BROMO-7A-METHYL-5-OXO-OCTAHYDRO-INDEN-1-YL-ESTER
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H25BrO5
InChI InChI=1S/C17H25BrO5/c1-9(19)22-13-7-14(23-15(21)16(2,3)4)17(5)8-11(18)12(20)6-10(13)17/h10-11,13-14H,6-8H2,1-5H3/t10-,11?,13+,14+,17+/m1/s1
InChIKey SYQSRXBAJYBJKJ-TXHGIBGJSA-N
Literature Reference Author U.YUNUS,R.IQBAL,E.WINTERFELDT
Literature Reference Citation J.HETCYCL.CHEM.,42,1079(2005)
Literature Reference DOI 10.1002/jhet.5570420607
Molecular Weight 389.287 g/mol
Sample ID 61273
Solvent CDCl3