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4,5,6,7-Tetrahydro-8-bromo-8-(1'-methylenethyl)-1,3-diphenyl-4,7-methanoisobenzofuran
SpectraBase Compound ID AmoKCFiRPdp
InChI InChI=1S/C24H21BrO/c1-15(2)24(25)18-13-14-19(24)21-20(18)22(16-9-5-3-6-10-16)26-23(21)17-11-7-4-8-12-17/h3-12,18-19H,1,13-14H2,2H3/t18-,19+,24-
InChIKey IJTLQCZSGUORHH-NHKMSHSESA-N
Mol Weight 405.34 g/mol
Molecular Formula C24H21BrO
Exact Mass 404.077578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JzvLpMkcJ1
Name 4,5,6,7-Tetrahydro-8-bromo-8-(1'-methylenethyl)-1,3-diphenyl-4,7-methanoisobenzofuran
Alternate Name(s) 10-bromo-10-isopropenyl-3,5-diphenyl-4-oxatricyclo[5.2.1.0(2,6)]deca-2,5-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21BrO
InChI InChI=1S/C24H21BrO/c1-15(2)24(25)18-13-14-19(24)21-20(18)22(16-9-5-3-6-10-16)26-23(21)17-11-7-4-8-12-17/h3-12,18-19H,1,13-14H2,2H3/t18-,19+,24-
InChIKey IJTLQCZSGUORHH-NHKMSHSESA-N
Molecular Weight 405.335 g/mol
SMILES c12c(c(-c3ccccc3)oc1-c1ccccc1)[C@]1([C@]([C@@]2(CC1)[H])(C(=C)C)Br)[H]
SPLASH splash10-0a4i-2401900000-1052d8149addd99e2ab6
Source of Spectrum KC-57-9085-58
Wiley ID 1626324