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(+-)-(1.alpha.,2a.alpha.,8b.alpha.)-1-(4-Chlorophenyl)-1,2,2a,8b-tetrahydro-8a-hydroxy-1-(p-tolyl)cyclobuta[a]naphthalene-3,4-dione

View entire compound with spectra: 1 MS (GC)

(+-)-(1.alpha.,2a.alpha.,8b.alpha.)-1-(4-Chlorophenyl)-1,2,2a,8b-tetrahydro-8a-hydroxy-1-(p-tolyl)cyclobuta[a]naphthalene-3,4-dione
SpectraBase Compound ID 4LFmSrMeR2z
InChI InChI=1S/C18H13ClO3/c19-11-7-5-10(6-8-11)14-9-15-17(21)16(20)12-3-1-2-4-13(12)18(14,15)22/h1-8,14-15,22H,9H2/t14-,15-,18+/m0/s1
InChIKey POHCPFKLLHMHMV-RLFYNMQTSA-N
Mol Weight 312.75 g/mol
Molecular Formula C18H13ClO3
Exact Mass 312.055322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIudMftpkyi
Name (+-)-(1.alpha.,2a.alpha.,8b.alpha.)-1-(4-Chlorophenyl)-1,2,2a,8b-tetrahydro-8a-hydroxy-1-(p-tolyl)cyclobuta[a]naphthalene-3,4-dione
Alternate Name(s) (+-)-(1.beta.,2a.beta.,8b.beta.)-1-(4-Chlorophenyl)-1,2,2a,8b-tetrahydro-8a-hydroxy-1-(p-tolyl)cyclobuta[a]naphthalene-3,4-dione (1S,2aR,8bR)-1-(4-chlorophenyl)-8b-hydroxy-1,2,2a,8b-tetrahydrocyclobuta[a]naphthalene-3,4-dione
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Formula C18H13ClO3
InChI InChI=1S/C18H13ClO3/c19-11-7-5-10(6-8-11)14-9-15-17(21)16(20)12-3-1-2-4-13(12)18(14,15)22/h1-8,14-15,22H,9H2/t14-,15-,18+/m0/s1
InChIKey POHCPFKLLHMHMV-RLFYNMQTSA-N
Molecular Weight 312.752 g/mol
SMILES O[C@@]12[C@@](C(=O)C(c3c2cccc3)=O)([H])C[C@]1(c1ccc(cc1)Cl)[H]
SPLASH splash10-0006-0902000000-a84e8e9ce7e74da15a9a
Source of Spectrum KC-0-119-6
Wiley ID 775835