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Tetracyclo[5.1.0.0(2,4).0(3,5)]octan-6-ol-8,8=dibromo-methanesulfonate
SpectraBase Compound ID FvTYsMXM3Dc
InChI InChI=1S/C9H10Br2O3S/c1-15(12,13)14-8-5-2-3(5)4(2)6-7(8)9(6,10)11/h2-8H,1H3/t2-,3+,4?,5?,6?,7?,8?
InChIKey VYVPDUHPBVWDEX-UAKONOQYSA-N
Mol Weight 358.04 g/mol
Molecular Formula C9H10Br2O3S
Exact Mass 355.871741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mpy5N4WjPY
Name Tetracyclo[5.1.0.0(2,4).0(3,5)]octan-6-ol-8,8=dibromo-methanesulfonate
Alternate Name(s) 8,8-Dibromotetracyclo[5.1.0.0(2,4).0(3,5)]oct-6-yl methanesulfonate
CAS Registry Number 110472-29-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10Br2O3S
InChI InChI=1S/C9H10Br2O3S/c1-15(12,13)14-8-5-2-3(5)4(2)6-7(8)9(6,10)11/h2-8H,1H3/t2-,3+,4?,5?,6?,7?,8?
InChIKey VYVPDUHPBVWDEX-UAKONOQYSA-N
Molecular Weight 358.044 g/mol
SMILES C12C(Br)(Br)C2C2[C@@]3(C([C@]23[H])C1OS(=O)(=O)C)[H]
SPLASH splash10-0ue9-8910000000-797e9d9f31c4a23c78a2
Source of Spectrum K-121-311-9
Wiley ID 1345462