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(1R*,4R*,5S*,8R*)-8-(1-hydroxyethyl)-4-methylbicyclo[3.2.2]nonan-6-one
SpectraBase Compound ID GKCOqPcusQw
InChI InChI=1S/C12H20O2/c1-7-3-4-9-5-12(14)10(7)6-11(9)8(2)13/h7-11,13H,3-6H2,1-2H3/t7-,8?,9+,10-,11+/m1/s1
InChIKey XYKYIDIZLXUUMZ-VDDSDDEXSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJhiH6SdSyY
Name (1R*,4R*,5S*,8R*)-8-(1-hydroxyethyl)-4-methylbicyclo[3.2.2]nonan-6-one
Alternate Name(s) (1R,4R,5S,8R)-8-(1-hydroxyethyl)-4-methylbicyclo[3.2.2]nonan-6-one
CAS Registry Number 104371-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-7-3-4-9-5-12(14)10(7)6-11(9)8(2)13/h7-11,13H,3-6H2,1-2H3/t7-,8?,9+,10-,11+/m1/s1
InChIKey XYKYIDIZLXUUMZ-VDDSDDEXSA-N
Molecular Weight 196.290 g/mol
SMILES OC([C@]1([C@@]2(CC([C@](C1)([C@@](CC2)(C)[H])[H])=O)[H])[H])C
SPLASH splash10-00nb-9600000000-e49ce534f66d736d5c37
Source of Spectrum B-39-439-10
Wiley ID 1193576