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(1S,2R,7R)-2-Methyl-bicyclo[5.3.0]decan-3-one
SpectraBase Compound ID JzMiZ8Iivas
InChI InChI=1S/C11H18O/c1-8-10-6-2-4-9(10)5-3-7-11(8)12/h8-10H,2-7H2,1H3/t8-,9-,10-/m1/s1
InChIKey MXSWDVUDYSLPCI-OPRDCNLKSA-N
Mol Weight 166.26 g/mol
Molecular Formula C11H18O
Exact Mass 166.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sQyZ7nGgC
Name (1S,2R,7R)-2-Methyl-bicyclo[5.3.0]decan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O
InChI InChI=1S/C11H18O/c1-8-10-6-2-4-9(10)5-3-7-11(8)12/h8-10H,2-7H2,1H3/t8-,9-,10-/m1/s1
InChIKey MXSWDVUDYSLPCI-OPRDCNLKSA-N
Molecular Weight 166.264 g/mol
SMILES [C@@]1([C@@]2([C@@](CCCC1=O)(CCC2)[H])[H])(C)[H]
SPLASH splash10-0671-9400000000-2121a0d05f1df399b18f
Source of Spectrum SO-0-1441-19
Synonyms (3aS,4R,8aR)-4-methyloctahydro-5(1H)-azulenone 2-endo/exo-2-Methylethylbicyclo[5.3.0]decan-3-one
Wiley ID 1546002