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7-Oxatricyclo[6.4.1.0(5,13)]tridecatriene
SpectraBase Compound ID 9Ikbn6fkmkk
InChI InChI=1S/C12H14O/c1-2-7-11-12-9(4-1)5-3-6-10(12)8-13-11/h3,5-6,11H,1-2,4,7-8H2
InChIKey OSPUCLXJJMPLJQ-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UectsZ6Rau
Name 7-Oxatricyclo[6.4.1.0(5,13)]tridecatriene
Alternate Name(s) 2,6,7,8,9,9a-Hexahydro-1-oxa-benzo[cd]azulene 6,7,8,9,9a,9b-hexahydrocyclohepta[cd][2]benzofuran
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Formula C12H14O
InChI InChI=1S/C12H14O/c1-2-7-11-12-9(4-1)5-3-6-10(12)8-13-11/h3,5-6,11H,1-2,4,7-8H2
InChIKey OSPUCLXJJMPLJQ-UHFFFAOYSA-N
Molecular Weight 174.243 g/mol
SMILES C12OCc3cccc(c23)CCCC1
SPLASH splash10-00di-0900000000-570560c14bd1cdcb8b41
Source of Spectrum F-53-15967-39
Wiley ID 804486