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#32;METHYL-2,16,17-TRICHLOROUNDECACYCLO-[9.9.0.0-(2,9).0-(3,7).0-(4,20).0-(5,18).0-(6,16).0-(8,15).0-(10,14).0-(12,19).0-(13,17)]-ICOSANE-1-CARBOXYLATE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

#32;METHYL-2,16,17-TRICHLOROUNDECACYCLO-[9.9.0.0-(2,9).0-(3,7).0-(4,20).0-(5,18).0-(6,16).0-(8,15).0-(10,14).0-(12,19).0-(13,17)]-ICOSANE-1-CARBOXYLATE
SpectraBase Compound ID 8DiV0LDAG7i
InChI InChI=1S/C22H19Cl3O2/c1-27-18(26)19-10-2-3-11(19)5-7-15(3)21(24)14(2)6-4(10)12-8-9(13(5)20(12,19)23)17(7)22(21,25)16(6)8/h2-17H,1H3
InChIKey OVWPZKRLKRTEOB-UHFFFAOYSA-N
Mol Weight 421.75 g/mol
Molecular Formula C22H19Cl3O2
Exact Mass 420.045063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9YUtZ1tKB7P
Name #32;METHYL-2,16,17-TRICHLOROUNDECACYCLO-[9.9.0.0-(2,9).0-(3,7).0-(4,20).0-(5,18).0-(6,16).0-(8,15).0-(10,14).0-(12,19).0-(13,17)]-ICOSANE-1-CARBOXYLATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19Cl3O2
InChI InChI=1S/C22H19Cl3O2/c1-27-18(26)19-10-2-3-11(19)5-7-15(3)21(24)14(2)6-4(10)12-8-9(13(5)20(12,19)23)17(7)22(21,25)16(6)8/h2-17H,1H3
InChIKey OVWPZKRLKRTEOB-UHFFFAOYSA-N
Literature Reference Author P.LANDENBERGER,K.SCHEUMANN,M.KELLER,D.HUNKLER,H.FRITZ,J.WOER TH,L.KNOTHE,H.PRINZB
Literature Reference Citation J.ORG.CHEM.,66,5744(2001)
Literature Reference DOI 10.1021/jo010170+
Molecular Weight 421.751 g/mol
Solvent Unknown
Source File Reference UWVN24059