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(E)-1,1,1-TRICHLORO-4-PYRROLIDIN-1-YL-3-PENTEN-2-ONE
SpectraBase Compound ID DUnOU0obkc6
InChI InChI=1S/C9H12Cl3NO/c1-7(13-4-2-3-5-13)6-8(14)9(10,11)12/h6H,2-5H2,1H3/b7-6+
InChIKey RXKSHDVMVAYMBE-VOTSOKGWSA-N
Mol Weight 256.56 g/mol
Molecular Formula C9H12Cl3NO
Exact Mass 254.998447 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KHzS3cbAuZd
Name (E)-1,1,1-TRICHLORO-4-PYRROLIDIN-1-YL-3-PENTEN-2-ONE
Compound Number 11L
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12Cl3NO
InChI InChI=1S/C9H12Cl3NO/c1-7(13-4-2-3-5-13)6-8(14)9(10,11)12/h6H,2-5H2,1H3/b7-6+
InChIKey RXKSHDVMVAYMBE-VOTSOKGWSA-N
Literature Reference Author M.A.P.MARTINS,E.A.GUARDA,C.P.FRIZZO,M.R.B.MARZARI,D.N.MOREIR A,N.ZANATTA,H.G.BONA
Literature Reference Citation MH.CHEM.,139,1321(2008)
Literature Reference DOI 10.1007/s00706-008-0923-3
Molecular Weight 256.559 g/mol
Sample ID 40155
Solvent CDCl3