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3-Methyloctahydrocyclobuta[c]inden-2(1H)-one
SpectraBase Compound ID 3ddh7wNxorF
InChI InChI=1S/C12H18O/c1-8-6-9-4-2-3-5-12(9)7-10(13)11(8)12/h8-9,11H,2-7H2,1H3
InChIKey MSTWXBDVVOPEDF-UHFFFAOYSA-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 GtXqMD19UU7
Name 3-Methyloctahydrocyclobuta[c]inden-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-8-6-9-4-2-3-5-12(9)7-10(13)11(8)12/h8-9,11H,2-7H2,1H3
InChIKey MSTWXBDVVOPEDF-UHFFFAOYSA-N
Molecular Weight 178.275 g/mol
SMILES C123C(C(C)CC3CCCC1)C(C2)=O
SPLASH splash10-00g3-6900000000-d582605da02826251c45
Source of Spectrum F-51-3447-28
Synonyms 5-Methyltricyclo[5.4.0.0(1,4)]]undecan-3-one
Wiley ID 791486