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(+)-(1S,2S,4R,6R)-2-Chloro-4-(2-chloro-2-propyl)-1-methylbicyclo[4.3.0]nonan-8-one
SpectraBase Compound ID 46okkXkG1iA
InChI InChI=1S/C13H20Cl2O/c1-12(2,15)8-4-9-5-10(16)7-13(9,3)11(14)6-8/h8-9,11H,4-7H2,1-3H3/t8-,9-,11+,13+/m1/s1
InChIKey SNQUQDXPLZFJIW-PLKZCJTGSA-N
Mol Weight 263.21 g/mol
Molecular Formula C13H20Cl2O
Exact Mass 262.089121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9RmsEoGLS7N
Name (+)-(1S,2S,4R,6R)-2-Chloro-4-(2-chloro-2-propyl)-1-methylbicyclo[4.3.0]nonan-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20Cl2O
InChI InChI=1S/C13H20Cl2O/c1-12(2,15)8-4-9-5-10(16)7-13(9,3)11(14)6-8/h8-9,11H,4-7H2,1-3H3/t8-,9-,11+,13+/m1/s1
InChIKey SNQUQDXPLZFJIW-PLKZCJTGSA-N
Molecular Weight 263.208 g/mol
SMILES [C@]12([C@](C[C@](C[C@@]2(Cl)[H])(C(Cl)(C)C)[H])(CC(C1)=O)[H])C
SPLASH splash10-052f-0920000000-f7b3ab9ba19afbdf6c87
Source of Spectrum K-2001-2043-9
Synonyms (3aS,4S,6R,7aR)-4-chloro-6-(1-chloro-1-methylethyl)-3a-methyloctahydro-2H-inden-2-one (3aR,5R,7S,7aS)-7-chloro-5-(2-chloropropan-2-yl)-7a-methyl-3,3a,4,5,6,7-hexahydro-1H-inden-2-one (3aR,5R,7S,7aS)-7-chloranyl-5-(2-chloranylpropan-2-yl)-7a-methyl-3,3a,4,5,6,7-hexahydro-1H-inden-2-one
Wiley ID 1579520