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(3A-S*,4-S*)-2,3,3A,4,5,6,7-HEPTACHLORO-4-(4-METHYL-1-PIPERAZINYLCARBONYL)-3A,4-DIHYDRO-1-H-INDEN-1-ONE
SpectraBase Compound ID EYG1RTU6QV0
InChI InChI=1S/C15H11Cl7N2O2/c1-23-2-4-24(5-3-23)13(26)15(22)11(19)8(17)7(16)6-10(25)9(18)12(20)14(6,15)21/h2-5H2,1H3/t14-,15-/m1/s1
InChIKey HXYPVGKWYYQLHA-HUUCEWRRSA-N
Mol Weight 499.4 g/mol
Molecular Formula C15H11Cl7N2O2
Exact Mass 495.864022 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JoDsdpM7WXl
Name (3A-S*,4-S*)-2,3,3A,4,5,6,7-HEPTACHLORO-4-(4-METHYL-1-PIPERAZINYLCARBONYL)-3A,4-DIHYDRO-1-H-INDEN-1-ONE
Compound Number VI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H11Cl7N2O2
InChI InChI=1S/C15H11Cl7N2O2/c1-23-2-4-24(5-3-23)13(26)15(22)11(19)8(17)7(16)6-10(25)9(18)12(20)14(6,15)21/h2-5H2,1H3/t14-,15-/m1/s1
InChIKey HXYPVGKWYYQLHA-HUUCEWRRSA-N
Literature Reference Author F.A.GIMALOVA-AKBUTINA,O.A.GAVRILOV,M.S.MIFTAKHOV
Literature Reference Citation RUSS.J.ORG.CHEM.,39,1264(2003)
Literature Reference DOI 10.1023/B:RUJO.0000010213.40932.06
Molecular Weight 499.436 g/mol
Solvent CDCl3
Source File Reference UWMZ23624