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5'-ACETOXYIMINO-4'-(4-CHLOROPHENYL)-2'-(4-CHLOROPHENYLIMINO)-1-OXO-2',3',4',5'-TETRAHYDROSPIRO-[CYCLOPENTANE-2,3'-THIOPHENE]
SpectraBase Compound ID LC6ECHFSuEL
InChI InChI=1S/C22H18Cl2N2O3S/c1-13(27)29-26-20-19(14-4-6-15(23)7-5-14)22(12-2-3-18(22)28)21(30-20)25-17-10-8-16(24)9-11-17/h4-11,19H,2-3,12H2,1H3/b25-21-,26-20-/t19-,22-/m1/s1
InChIKey KEMLOQPYWWWHLC-XARWUEHNSA-N
Mol Weight 461.36 g/mol
Molecular Formula C22H18Cl2N2O3S
Exact Mass 460.041519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8hCS0QJDqVH
Name 5'-ACETOXYIMINO-4'-(4-CHLOROPHENYL)-2'-(4-CHLOROPHENYLIMINO)-1-OXO-2',3',4',5'-TETRAHYDROSPIRO-[CYCLOPENTANE-2,3'-THIOPHENE]
Compound Number 9F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H18Cl2N2O3S
InChI InChI=1S/C22H18Cl2N2O3S/c1-13(27)29-26-20-19(14-4-6-15(23)7-5-14)22(12-2-3-18(22)28)21(30-20)25-17-10-8-16(24)9-11-17/h4-11,19H,2-3,12H2,1H3/b25-21-,26-20-/t19-,22-/m1/s1
InChIKey KEMLOQPYWWWHLC-XARWUEHNSA-N
Literature Reference Author K.BOGDANOWICZ-SZWED,R.GIL
Literature Reference Citation MH.CHEM.,135,1415(2004)
Literature Reference DOI 10.1007/s00706-004-0185-7
Molecular Weight 461.363 g/mol
Solvent CDCl3
Source File Reference UWMZ11997