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(-)-(3S,8R)-1,8,9,10-Tetrachloro-11,11-dimethoxy-6-{[1',10',10'-trimethyl-3'-oxotricyclo[5.2.1.0(2,6)]dec-4-yl]oxy}tricyclo[6.2.1.0(2,7)]undeca-4,9-dien-3-ol
SpectraBase Compound ID FVUZuC0X6jG
InChI InChI=1S/C25H32Cl4O5/c1-21(2)12-8-9-22(21,3)20-11(12)10-15(34-20)33-14-7-6-13(30)16-17(14)24(29)19(27)18(26)23(16,28)25(24,31-4)32-5/h6-7,11-17,20,30H,8-10H2,1-5H3/t11-,12-,13+,14-,15?,16?,17?,20-,22+,23-,24+/m0/s1
InChIKey ATAQPTOMSUFISM-KIGPEWQKSA-N
Mol Weight 554.3 g/mol
Molecular Formula C25H32Cl4O5
Exact Mass 552.100385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IwiR0PziACs
Name (-)-(3S,8R)-1,8,9,10-Tetrachloro-11,11-dimethoxy-6-{[1',10',10'-trimethyl-3'-oxotricyclo[5.2.1.0(2,6)]dec-4-yl]oxy}tricyclo[6.2.1.0(2,7)]undeca-4,9-dien-3-ol
Alternate Name(s) (-)-(1S,2S,3R,6S,7R,8R)-1,8,9,10-Tetrachloro-11,11-dimethoxy-6-{[(1'R,2'R,4'R,6'R,7'R)-1',10',10'-trimethyl-3'-oxotricyclo[5.2.1.0(2,6)]dec-4-yl]oxy}tricyclo[6.2.1.0(2,7)]undeca-4,9-dien-3-ol (3R,6S)-1,8,9,10-tetrachloro-11,11-dimethoxy-6-[(1,10,10-trimethyl-3-oxatricyclo[5.2.1.0(2,6)]dec-4-yl)oxy]tricyclo[6.2.1.0(2,7)]undeca-4,9-dien-3-ol
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Formula C25H32Cl4O5
InChI InChI=1S/C25H32Cl4O5/c1-21(2)12-8-9-22(21,3)20-11(12)10-15(34-20)33-14-7-6-13(30)16-17(14)24(29)19(27)18(26)23(16,28)25(24,31-4)32-5/h6-7,11-17,20,30H,8-10H2,1-5H3/t11-,12-,13+,14-,15?,16?,17?,20-,22+,23-,24+/m0/s1
InChIKey ATAQPTOMSUFISM-KIGPEWQKSA-N
Molecular Weight 554.338 g/mol
SMILES O[C@]1(C2C([C@@]3(C([C@@]2(Cl)C(=C3Cl)Cl)(OC)OC)Cl)[C@](C=C1)(OC1O[C@@]2([C@]3(CC[C@](C3(C)C)([C@@]2(C1)[H])[H])C)[H])[H])[H]
SPLASH splash10-03fr-2970000000-bb990fc901b2c8bfb441
Source of Spectrum F-53-3091-20
Wiley ID 800780