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7-Butyl-5-methylcyclopenta[a]benzo[b]furan isomer
SpectraBase Compound ID 4lmYBE8h8m3
InChI InChI=1S/C16H20O/c1-3-4-6-13-10-12-7-5-8-14(12)15-9-11(2)17-16(13)15/h9-10H,3-8H2,1-2H3
InChIKey MHGWNEWUBDSXIS-UHFFFAOYSA-N
Mol Weight 228.33 g/mol
Molecular Formula C16H20O
Exact Mass 228.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3anIwsEf2m
Name 7-Butyl-5-methylcyclopenta[a]benzo[b]furan isomer
Alternate Name(s) 4-butyl-2-methyl-7,8-dihydro-6H-cyclopenta[e][1]benzofuran
Comments Less than 3 mono-isotopic peaks
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Formula C16H20O
InChI InChI=1S/C16H20O/c1-3-4-6-13-10-12-7-5-8-14(12)15-9-11(2)17-16(13)15/h9-10H,3-8H2,1-2H3
InChIKey MHGWNEWUBDSXIS-UHFFFAOYSA-N
Molecular Weight 228.335 g/mol
SMILES c12c(oc(c2)C)c(CCCC)cc2c1CCC2
SPLASH splash10-004r-0790000000-53cfda916f8b007c85fd
Source of Spectrum AT-41-8690-12
Wiley ID 854886