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4a,8a-Ethanonaphthalen-1-ol, 9,10-dichlorooctahydro-, (1.alpha.,4a.alpha.,8a.alpha.,9S*,10S*)-
SpectraBase Compound ID FlybhyvjDU9
InChI InChI=1S/C12H18Cl2O/c13-9-10(14)12-7-2-1-5-11(9,12)6-3-4-8(12)15/h8-10,15H,1-7H2/t8-,9-,10-,11-,12+/m1/s1
InChIKey PGPQKLIDFLBVBO-OOCWMUITSA-N
Mol Weight 249.18 g/mol
Molecular Formula C12H18Cl2O
Exact Mass 248.073471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CEjDP55dyl7
Name 4a,8a-Ethanonaphthalen-1-ol, 9,10-dichlorooctahydro-, (1.alpha.,4a.alpha.,8a.alpha.,9S*,10S*)-
Alternate Name(s) (1S,2R,6S,11S,12S)-11,12-dichlorotricyclo[4.4.2.0(1,6)]dodecan-2-ol 11,12-Dichlorotricyclo[4.4.2.0]dodecan-2-ol
CAS Registry Number 59177-24-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18Cl2O
InChI InChI=1S/C12H18Cl2O/c13-9-10(14)12-7-2-1-5-11(9,12)6-3-4-8(12)15/h8-10,15H,1-7H2/t8-,9-,10-,11-,12+/m1/s1
InChIKey PGPQKLIDFLBVBO-OOCWMUITSA-N
Molecular Weight 249.181 g/mol
SMILES O[C@]1([C@]23[C@@](CCC1)(CCCC3)[C@@]([C@]2(Cl)[H])(Cl)[H])[H]
SPLASH splash10-0a4i-0900000000-de76209eeffb2589aa98
Source of Spectrum B-28-2679-0
Wiley ID 1250801