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(3aR,5aR,8aS,8bR)-4-Bromo-6,6-dichloro-2,2-dimethyl-3a,5a,6,8,8a,8b-hexahydro-1,3-dioxa-as-indacen-7-one
SpectraBase Compound ID CQkuWkm2sRs
InChI InChI=1S/C12H13BrCl2O3/c1-11(2)17-9-5-3-8(16)12(14,15)6(5)4-7(13)10(9)18-11/h4-6,9-10H,3H2,1-2H3/t5-,6-,9+,10-/m0/s1
InChIKey SCASKOSQFAQIBP-DERVNVNRSA-N
Mol Weight 356.04 g/mol
Molecular Formula C12H13BrCl2O3
Exact Mass 353.942513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14AU4vZ9MaO
Name (3aR,5aR,8aS,8bR)-4-Bromo-6,6-dichloro-2,2-dimethyl-3a,5a,6,8,8a,8b-hexahydro-1,3-dioxa-as-indacen-7-one
Alternate Name(s) 4-Bromo-6,6-dichloro-2,2-dimethyl-(hexahydro)-1,3-dioxa[a,s]indacen-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13BrCl2O3
InChI InChI=1S/C12H13BrCl2O3/c1-11(2)17-9-5-3-8(16)12(14,15)6(5)4-7(13)10(9)18-11/h4-6,9-10H,3H2,1-2H3/t5-,6-,9+,10-/m0/s1
InChIKey SCASKOSQFAQIBP-DERVNVNRSA-N
Molecular Weight 356.043 g/mol
SMILES [C@@]12(C(C(=O)C[C@@]2([C@@]2([C@@](OC(O2)(C)C)(C(=C1)Br)[H])[H])[H])(Cl)Cl)[H]
SPLASH splash10-000f-2349000000-a7d525b5c0cae75e172b
Source of Spectrum QE-14-7243-11
Wiley ID 1692280