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{( 1S*,3R*,4S*,,5S*,7S*,8R*,9S*,10R*,12R*)-4,5,7-Trichloro-3-ethoxy-12-isopropyl-6,6-dimethoxy-9-methyl-2-oxatetracyclo[6.4.0.0(3,7).0(5,9)]dodec-10-yl} methylsulfonate

Compound with spectra: 1 MS (GC)

{( 1S*,3R*,4S*,,5S*,7S*,8R*,9S*,10R*,12R*)-4,5,7-Trichloro-3-ethoxy-12-isopropyl-6,6-dimethoxy-9-methyl-2-oxatetracyclo[6.4.0.0(3,7).0(5,9)]dodec-10-yl} methylsulfonate
SpectraBase Compound ID E28KlA4BKtR
InChI InChI=1S/C20H31Cl3O7S/c1-8-28-19-15(21)18(23)16(4)12(30-31(7,24)25)9-11(10(2)3)13(29-19)14(16)17(19,22)20(18,26-5)27-6/h10-15H,8-9H2,1-7H3/t11?,12?,13-,14-,15+,16+,17-,18-,19+/m1/s1
InChIKey UBVCEEXTMXPRTM-FMHHDJNESA-N
Mol Weight 521.88 g/mol
Molecular Formula C20H31Cl3O7S
Exact Mass 520.085608 g/mol
Enantiomer InChIKey UBVCEEXTMXPRTM-VHPSAHSLSA-N

View Spectrum of {( 1S*,3R*,4S*,,5S*,7S*,8R*,9S*,10R*,12R*)-4,5,7-Trichloro-3-ethoxy-12-isopropyl-6,6-dimethoxy-9-methyl-2-oxatetracyclo[6.4.0.0(3,7).0(5,9)]dodec-10-yl} methylsulfonate

MS (GC) Spectrum
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Source of Spectrum AH-125-1002-7
(+/-)-(1S*,3R*,4S*,5S*,7S*,8R*,9S*,10R*,12R*)-{4,5,7-TRICHLOR-3-ETHOXY-12-ISOPROPYL-6,6-DIMETHOXY-9-METHYL-2-OXATETRACYCLO-[6.4.0.0(3,7).0(5,9)]-DODEC-10-YL}-
13',16':18',21'-dietheno-1,1''-diethyl-3',14',20',31'-tetramethyldispiro[piperidine-4,17'-[5,12,22,29]tetraoxa[37,40,41]triazatetracyclo[31.13.1.0.(4,45).0(30,35)]heptatetraconta-1',3',13',15',18',20',30',34',35',45'-decaene-47',4''-piperidine]-38',42'-dione
Methyl 2.beta.-(2'-(m-isopropyl-phenyl)ethyl)-1.beta.,3.alpha.-dimethyl-cyclohexanecarboxylate (so name and structure in Anderson & Botto) but MS (intense fragement at m/z = 187) and RT suggest 2.alpha.-epimer instead, with Reg. No. 19556-80-0? a methyl seco-dehydro-abietate
6H,13H-5,13:6,12-Dietheno-5a,12a-(methaniminomethano)-1H,5H,8H,12H-[1,2,4]triazolo[1,2-a][1,2,4]triazolo[1',2':1,2]pyridazino[4,5-d]pyridazine-18-acetic acid, 2,3,9,10-tetrahydro-.alpha.-(2-methylpropyl)-1,3,8,10,17,19-hexaoxo-2,9-diphenyl-, hexyl ester, stereoisomer
2-Propenoic acid, 3-phenyl-, 1,1a,1b,1c,2a,3,3a,4,6a,6b,7,8-dodecahydro-3a,6b-dihydroxy-1,1,5,7-tetramethyl-4-oxo-2a-[[(1-oxo-3-phenyl-2-propenyl)oxy]methyl]-8aH-cyclopropa[5',6']benz[1',2':7,8]az uleno[5,6-b]oxirene-8,8a-diyl ester, [1aR-(1a.alpha.,1b.beta.,1c.beta.,2a.beta.,3a.beta.,6a.alpha.,6b.alpha.,7.alpha.,8.beta.,8a.alpha.)]-
Cobalt, bis(cyano-C)(8,11-diethyl-2,3,3a,7,8,9,10,11,12,16,17,20a-dodecahydro-3a,4,8,9,12,14,17,17-octamethyl-7,12,16,20a-tetrapropyl-10,13-imino-4,20:9,16:18,15-trinitrilo-6H-cyclononadeca[b]furan-5(4H)-onato-N21,N22,N23,N24)-, stereoisomer
1,6-Dioxaspiro[4.5]decane-7-hexanoic acid, 2-[5-ethyltetrahydro-5-[tetrahydro-3-methyl-5-[tetrahydro-6-(hydroxym ethyl)-3,5-dimethyl-2H-pyran-2-yl]-2-furyl]-2-furyl]-9-hydroxy-.delta.-methoxy-.epsilon.,2,8-trimethyl-, methyl ester, diacetate
{(4a,5,6,7,7a-.eta.)-4-(2",2"-Dimethyl-1",3"-dioxolan-4"-yl)-3a,5,8,8a-tetrahydro-2,2-dimethyl-4H-indeno[5,6-d]-1,3-dioxol-5-yl}-{(4',5',6',7',7a'-.eta.)-5'-(chloromercurio)-4'-(2"',2"'-dimethyl-1'",3'"-dioxolan-4"'-yl}-3a',5',8',8a'-tetrahydro-2',2'-dimethyl-4H-indeno5,6-d]-1',3'-dioxol-5'-yl}- iron (II)
Cobalt, bis(cyano-C)(8,11-diethyl-2,3,3a,7,8,9,10,11,12,16,17,20a-dodecahydro-3a,5,8,9,12,14,17,17-octamethyl-7,12,16,20a-tetrapropyl-10,13-imino-4,20:9,16:18,15-trinitrilo-6H-cyclononadeca[b]furanato-N21,N22,N23,N24)-, stereoisomer
Dispiro[piperidine-4,2'-[7,14,24,31]tetraoxapentacyclo[30.2.2.23,6.215,18.220,23]dotetraconta[3,5,15,17,20,22,32,34,35,37,39,41]dodecaen e-19',4''-piperidine], 1,1''-diacetyl-5',33'-dibromo-16',22',36',37',40',41'-hexamethyl-
6H,10H,16H,18H,32H,34H-5,9:17,21-Dimethano-11,15-metheno-1,25[1',3']-pyrimidino-5H,27H-dibenzo[b,u][1,23,4,8,16,20]dioxatetraazacyclohexa cosine-32,37,39-trione, 7,8,19,20,28,29,35,36-octahydro-38-methoxy-13-methyl-
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