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Spiro[1,3-dioxolane-2,1'(2'H)-[4a,8a]ethanonaphthalene], 9',10'-dichlorohexahydro-7'-(1-methylethyl)-, (4'a.alpha.,7'.beta.,8'a.alpha.,9'S*,10'R*)-
SpectraBase Compound ID I7mlmWUHoio
InChI InChI=1S/C17H26Cl2O2/c1-11(2)12-4-7-15-5-3-6-17(20-8-9-21-17)16(15,10-12)14(19)13(15)18/h11-14H,3-10H2,1-2H3/t12-,13?,14?,15+,16+/m1/s1
InChIKey RLRSMMQECBTTQB-WNZFAQLISA-N
Mol Weight 333.3 g/mol
Molecular Formula C17H26Cl2O2
Exact Mass 332.130985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZ1oaQKQdQh
Name Spiro[1,3-dioxolane-2,1'(2'H)-[4a,8a]ethanonaphthalene], 9',10'-dichlorohexahydro-7'-(1-methylethyl)-, (4'a.alpha.,7'.beta.,8'a.alpha.,9'S*,10'R*)-
Alternate Name(s) (1'S,6'R,9'R)-11',12'-dichloro-9'-(propan-2-yl)spiro[1,3-dioxolane-2,2'-tricyclo[4.4.2.0(1,6)]dodecane] Ethylene acetal derivative of 11,12-dichloro-9-isopropyltricyclo[4.4.2.0]dodecan-one
CAS Registry Number 59177-27-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26Cl2O2
InChI InChI=1S/C17H26Cl2O2/c1-11(2)12-4-7-15-5-3-6-17(20-8-9-21-17)16(15,10-12)14(19)13(15)18/h11-14H,3-10H2,1-2H3/t12-,13?,14?,15+,16+/m1/s1
InChIKey RLRSMMQECBTTQB-WNZFAQLISA-N
Molecular Weight 333.299 g/mol
SMILES [C@]123[C@](CC[C@](C3)(C(C)C)[H])(CCCC11OCCO1)C(C2Cl)Cl
SPLASH splash10-0002-9000000000-d3c1938aebd7f95c8530
Source of Spectrum B-28-2679-0
Wiley ID 1329287