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3-Chloro-1,9-diphenyl-16-oxapentacyclo[7.6.1.0(2,8).0(3,8).0(10,15)]hexadecane-5,10,12,14-tetraene
SpectraBase Compound ID EmC2UFjhAQc
InChI InChI=1S/C27H21ClO/c28-27-23-17-9-10-18-24(23,27)25(19-11-3-1-4-12-19)21-15-7-8-16-22(21)26(27,29-25)20-13-5-2-6-14-20/h1-16,23H,17-18H2
InChIKey OQZXLHNAQRQCSV-UHFFFAOYSA-N
Mol Weight 396.92 g/mol
Molecular Formula C27H21ClO
Exact Mass 396.128093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5IGJtsSXCg
Name 3-Chloro-1,9-diphenyl-16-oxapentacyclo[7.6.1.0(2,8).0(3,8).0(10,15)]hexadecane-5,10,12,14-tetraene
Alternate Name(s) 2-Chloro-1,9-diphenyl-16-oxapentacyclo[7.6.1.0(2,8).0(3,8).0(10,15)]hexadecane-5,10,12,14-tetraene 7-Chloro-1,9-diphenyl-16-oxapentacyclo[7.6.1.0(2,7).0(2,8).0(10,15)]hexadeca-4,10,12,14-tetraene
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Formula C27H21ClO
InChI InChI=1S/C27H21ClO/c28-27-23-17-9-10-18-24(23,27)25(19-11-3-1-4-12-19)21-15-7-8-16-22(21)26(27,29-25)20-13-5-2-6-14-20/h1-16,23H,17-18H2
InChIKey OQZXLHNAQRQCSV-UHFFFAOYSA-N
Molecular Weight 396.917 g/mol
SMILES C123C(C4(c5ccccc5)OC1(c1c4cccc1)c1ccccc1)(Cl)C2CC=CC3
SPLASH splash10-03di-0019000000-2317296485065c0cc768
Source of Spectrum J-57-4082-13
Wiley ID 1367733