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2(3H)-Benzofuranone, 6,7-dibromo-3a,6,7,7a-tetrahydro-3a-phenyl-, (3a.alpha.,6.alpha.,7.beta.,7a.alpha.)-(.+-.)-
SpectraBase Compound ID A7AqvQuvZth
InChI InChI=1S/C14H12Br2O2/c15-10-6-7-14(9-4-2-1-3-5-9)8-11(17)18-13(14)12(10)16/h1-7,10,12-13H,8H2/t10-,12+,13+,14+/m1/s1
InChIKey CHAQYQXYDLVYLX-SAXRGWBVSA-N
Mol Weight 372.06 g/mol
Molecular Formula C14H12Br2O2
Exact Mass 369.920406 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4akVx3K97fE
Name 2(3H)-Benzofuranone, 6,7-dibromo-3a,6,7,7a-tetrahydro-3a-phenyl-, (3a.alpha.,6.alpha.,7.beta.,7a.alpha.)-(.+-.)-
CAS Registry Number 86983-27-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12Br2O2
InChI InChI=1S/C14H12Br2O2/c15-10-6-7-14(9-4-2-1-3-5-9)8-11(17)18-13(14)12(10)16/h1-7,10,12-13H,8H2/t10-,12+,13+,14+/m1/s1
InChIKey CHAQYQXYDLVYLX-SAXRGWBVSA-N
Molecular Weight 372.056 g/mol
SMILES [C@@]12([C@@](OC(C2)=O)([C@@](Br)([C@@](C=C1)(Br)[H])[H])[H])c1ccccc1
SPLASH splash10-0mix-1910000000-03a8abfa57523facd898
Source of Spectrum H-66-779-0
Synonyms (3aR,6R,7R,7aR)-6,7-dibromo-3a-phenyl-3a,6,7,7a-tetrahydro-1-benzofuran-2(3H)-one (3aRS,6RS,7RS,7aRS)-6,7-dibromo-3a-phenyl-3a,6,7,7a-2(3H)-benzo[b]furnanone
Wiley ID 1353951