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12-Acetoxy-9,10,11,12-tetrahydrocyclohepta[a]phenalen-7(8H)-one
SpectraBase Compound ID DrQyUkds3vS
InChI InChI=1S/C20H18O3/c1-12(21)23-17-11-3-2-8-16-19(17)14-9-4-6-13-7-5-10-15(18(13)14)20(16)22/h4-7,9-10,17H,2-3,8,11H2,1H3
InChIKey UXVCIXOKVPBZOB-UHFFFAOYSA-N
Mol Weight 306.36 g/mol
Molecular Formula C20H18O3
Exact Mass 306.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6TRkKxw8i0I
Name 12-Acetoxy-9,10,11,12-tetrahydrocyclohepta[a]phenalen-7(8H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C20H18O3
InChI InChI=1S/C20H18O3/c1-12(21)23-17-11-3-2-8-16-19(17)14-9-4-6-13-7-5-10-15(18(13)14)20(16)22/h4-7,9-10,17H,2-3,8,11H2,1H3
InChIKey UXVCIXOKVPBZOB-UHFFFAOYSA-N
Molecular Weight 306.361 g/mol
SMILES C12=C(C(=O)c3c4c2cccc4ccc3)CCCCC1OC(=O)C
SPLASH splash10-0002-0090000000-2665d343c4d8379be3c6
Source of Spectrum AJ-64-980-22
Synonyms 12-Acetoxy-9,10,11,12-tetrahydrocyclohepta[a]phenanlen-7(8H)-one 7-oxo-7,8,9,10,11,12-hexahydrocyclohepta[a]phenalen-12-yl acetate
Wiley ID 1308473