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1,4-Methanobiphenylen-9-one, 6-bromo-1,2,3,4,4a,8b-hexahydro-, (1.alpha.,4.alpha.,4a.beta.,8b.beta.)-
SpectraBase Compound ID 8A2n6j2rZY1
InChI InChI=1S/C13H11BrO/c14-6-1-2-7-10(5-6)12-9-4-3-8(11(7)12)13(9)15/h1-2,5,8-9,11-12H,3-4H2/t8-,9+,11+,12+/m0/s1
InChIKey UODRHHYIOWYBLI-LUTQBAROSA-N
Mol Weight 263.13 g/mol
Molecular Formula C13H11BrO
Exact Mass 261.999328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21QPifuydE
Name 1,4-Methanobiphenylen-9-one, 6-bromo-1,2,3,4,4a,8b-hexahydro-, (1.alpha.,4.alpha.,4a.beta.,8b.beta.)-
CAS Registry Number 75854-64-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11BrO
InChI InChI=1S/C13H11BrO/c14-6-1-2-7-10(5-6)12-9-4-3-8(11(7)12)13(9)15/h1-2,5,8-9,11-12H,3-4H2/t8-,9+,11+,12+/m0/s1
InChIKey UODRHHYIOWYBLI-LUTQBAROSA-N
Molecular Weight 263.134 g/mol
SMILES [C@]12([C@@]([C@]3([H])C([C@]2(CC3)[H])=O)([H])c2c1ccc(Br)c2)[H]
SPLASH splash10-08fr-0290000000-d0d2047f7a9dc3c0a6ad
Source of Spectrum B-33-1502-0
Synonyms (1.alpha.,4.alpha.,4a.beta.,8b.beta.)-6-Bromo-1,2,3,4,4a,8b-hexahydro-1,4-methanobiphenylen-9-one (1S,2R,9S,10R)-5-bromotetracyclo[8.2.1.0(2,9).0(3,8)]trideca-3,5,7-trien-13-one
Wiley ID 1265542