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Bicyclo[3.3.1]non-2-en-9-one, 1,2,6-trimethyl-, exo-(.+-.)-
SpectraBase Compound ID Jrj58nADeHj
InChI InChI=1S/C12H18O/c1-8-6-7-12(3)9(2)4-5-10(8)11(12)13/h4,8,10H,5-7H2,1-3H3/t8-,10+,12+/m1/s1
InChIKey ZHXNJJJUNQYOGD-HLUHBDAQSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZM3MNbLtaM
Name Bicyclo[3.3.1]non-2-en-9-one, 1,2,6-trimethyl-, exo-(.+-.)-
CAS Registry Number 95852-34-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-8-6-7-12(3)9(2)4-5-10(8)11(12)13/h4,8,10H,5-7H2,1-3H3/t8-,10+,12+/m1/s1
InChIKey ZHXNJJJUNQYOGD-HLUHBDAQSA-N
Molecular Weight 178.275 g/mol
SMILES [C@]12(C([C@]([H])([C@@](CC2)(C)[H])CC=C1C)=O)C
SPLASH splash10-0006-9300000000-3b97f6a0f5e7d1a70ba0
Source of Spectrum J-50-2679-5
Synonyms (1.alpha.,5.alpha.,6.beta.)-1,2,6-trimethylbicyclo[3.3.1]non-2-en-9-one (1R,5R,6R)-1,2,6-trimethylbicyclo[3.3.1]non-2-en-9-one
Wiley ID 1174726