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12-Hydroxy-9,10,11,12-tetrahydrocyclohepta[a]phenalen-7(8H)-one
SpectraBase Compound ID JRGINNQANQl
InChI InChI=1S/C18H16O2/c19-15-10-2-1-7-14-17(15)12-8-3-5-11-6-4-9-13(16(11)12)18(14)20/h3-6,8-9,15,19H,1-2,7,10H2
InChIKey ZVUYPQBKRKCOEP-UHFFFAOYSA-N
Mol Weight 264.32 g/mol
Molecular Formula C18H16O2
Exact Mass 264.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GEJ1Rcd6jFi
Name 12-Hydroxy-9,10,11,12-tetrahydrocyclohepta[a]phenalen-7(8H)-one
Alternate Name(s) 12-Hydrxy-9,10,11,12-tetrahydrocyclohepta[a]phenanlen-7(8H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H16O2
InChI InChI=1S/C18H16O2/c19-15-10-2-1-7-14-17(15)12-8-3-5-11-6-4-9-13(16(11)12)18(14)20/h3-6,8-9,15,19H,1-2,7,10H2
InChIKey ZVUYPQBKRKCOEP-UHFFFAOYSA-N
Molecular Weight 264.324 g/mol
SMILES OC1C2=C(C(c3c4c(cccc24)ccc3)=O)CCCC1
SPLASH splash10-001i-0920000000-c9c45027b4e3b1526189
Source of Spectrum AJ-64-980-23
Wiley ID 1268515