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(3R*,1'S*,2'S*,3'S*,4'R*)-3-(3'-Methylbicyclo[2.2.1]hept-2'-yl]cyclopentanone
SpectraBase Compound ID KKrT0JvL3Sh
InChI InChI=1S/C13H20O/c1-8-9-2-3-10(6-9)13(8)11-4-5-12(14)7-11/h8-11,13H,2-7H2,1H3/t8-,9+,10-,11+,13-/m1/s1
InChIKey HQMYOBZDQCDXFR-OOTJXSFTSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WwtQh78BHb
Name (3R*,1'S*,2'S*,3'S*,4'R*)-3-(3'-Methylbicyclo[2.2.1]hept-2'-yl]cyclopentanone
Alternate Name(s) (3R)-3-[(1S,2S,3S,4R)-3-methylbicyclo[2.2.1]hept-2-yl]cyclopentanone (S)-3-((1R*,2R*,3R*,4S*)-3-Methyl-bicyclo[2.2.1]hept-2-yl)-cyclopentanone (3S)-3-[(1S,2R,3R,4R)-2-methyl-3-bicyclo[2.2.1]heptanyl]-1-cyclopentanone (3S)-3-[(1S,2R,3R,4R)-2-methyl-3-bicyclo[2.2.1]heptanyl]cyclopentan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H20O
InChI InChI=1S/C13H20O/c1-8-9-2-3-10(6-9)13(8)11-4-5-12(14)7-11/h8-11,13H,2-7H2,1H3/t8-,9+,10-,11+,13-/m1/s1
InChIKey HQMYOBZDQCDXFR-OOTJXSFTSA-N
Molecular Weight 192.302 g/mol
SMILES [C@]1([C@]2(C[C@@]([C@]1(C)[H])(CC2)[H])[H])([C@@]1(CC(=O)CC1)[H])[H]
SPLASH splash10-0a4l-0900000000-b73a6542726aa8aa52eb
Source of Spectrum J-63-2784-9
Wiley ID 1189072