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3,3-dichloro-5-(2-chloropropan-2-yl)-7a-methyl-1,3a,4,5,6,7-hexahydroindol-2-one
SpectraBase Compound ID 8oWv7XGcqgM
InChI InChI=1S/C12H18Cl3NO/c1-10(2,13)7-4-5-11(3)8(6-7)12(14,15)9(17)16-11/h7-8H,4-6H2,1-3H3,(H,16,17)
InChIKey PUZYRSQABCNNSR-UHFFFAOYSA-N
Mol Weight 298.64 g/mol
Molecular Formula C12H18Cl3NO
Exact Mass 297.045397 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7dJlxVJ8RbY
Name 3,3-dichloro-5-(2-chloropropan-2-yl)-7a-methyl-1,3a,4,5,6,7-hexahydroindol-2-one
CAS Registry Number 138816-28-1
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18Cl3NO
InChI InChI=1S/C12H18Cl3NO/c1-10(2,13)7-4-5-11(3)8(6-7)12(14,15)9(17)16-11/h7-8H,4-6H2,1-3H3,(H,16,17)
InChIKey PUZYRSQABCNNSR-UHFFFAOYSA-N
Literature Reference Author H.NAGASHIMA,H.WAKAMATSU,N.OZAKI,T.ISHII,M.WATANABE,T.TAJIMA, K.ITOH
Literature Reference Citation J.ORG.CHEM.,57,1682(1992)
Literature Reference DOI 10.1021/jo00032a016
Molecular Weight 298.640 g/mol
Solvent CDCl3
Source File Reference UWCS2513