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(2.alpha.,3.alpha.,4a.beta.,8a.beta.)-9,9-dichloro-1,2,3,4,5,8-hexahydro-4a,8a-methanonaphthalene-2,3-diol
SpectraBase Compound ID A6aF27TQx9g
InChI InChI=1S/C11H14Cl2O2/c12-11(13)9-3-1-2-4-10(9,11)6-8(15)7(14)5-9/h1-2,7-8,14-15H,3-6H2/t7-,8+,9+,10-
InChIKey JXSDDYFPOOMHAA-FIRGSJFUSA-N
Mol Weight 249.14 g/mol
Molecular Formula C11H14Cl2O2
Exact Mass 248.037085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D5bOZ9eOLGv
Name (2.alpha.,3.alpha.,4a.beta.,8a.beta.)-9,9-dichloro-1,2,3,4,5,8-hexahydro-4a,8a-methanonaphthalene-2,3-diol
CAS Registry Number 110045-37-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14Cl2O2
InChI InChI=1S/C11H14Cl2O2/c12-11(13)9-3-1-2-4-10(9,11)6-8(15)7(14)5-9/h1-2,7-8,14-15H,3-6H2/t7-,8+,9+,10-
InChIKey JXSDDYFPOOMHAA-FIRGSJFUSA-N
Molecular Weight 249.137 g/mol
SMILES O[C@]1([C@](C[C@]23[C@@](C1)(CC=CC3)C2(Cl)Cl)(O)[H])[H]
SPLASH splash10-0006-9030000000-57ebf7474f2db354ed49
Source of Spectrum J-52-4853-5
Synonyms (1R,3S,4R,6S)-11,11-dichlorotricyclo[4.4.1.0(1,6)]undec-8-ene-3,4-diol
Wiley ID 1250623