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5,7,8,9-tetrahydrospiro[6h-benzocycloheptene-6,4'-cyclohex-2'-en]-1'-one
SpectraBase Compound ID 9JzEutYmatJ
InChI InChI=1S/C16H18O/c17-15-7-10-16(11-8-15)9-3-6-13-4-1-2-5-14(13)12-16/h1-2,4-5,7,10H,3,6,8-9,11-12H2
InChIKey RUNVDZBWZORKKV-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVOO5tYZiQL
Name 5,7,8,9-tetrahydrospiro[6h-benzocycloheptene-6,4'-cyclohex-2'-en]-1'-one
CAS Registry Number 101955-03-7
Comments Less than 3 mono-isotopic peaks
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Formula C16H18O
InChI InChI=1S/C16H18O/c17-15-7-10-16(11-8-15)9-3-6-13-4-1-2-5-14(13)12-16/h1-2,4-5,7,10H,3,6,8-9,11-12H2
InChIKey RUNVDZBWZORKKV-UHFFFAOYSA-N
Molecular Weight 226.319 g/mol
SMILES C12(C=CC(CC2)=O)Cc2c(cccc2)CCC1
SPLASH splash10-0a4i-0900000000-847c051b38cd32e0cb7e
Source of Spectrum J-51-2166-5
Synonyms 5,7,8,9-tetrahydrospiro[-benzo[7]annulene-6,1'-cyclohexan]-2'-en-4'-one
Wiley ID 1228220