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1,3,5,5-Tetramethyl-7,7-dibromo-4'-chloro-1',2'-benzobicyclo[3.3.1]non-2-ene
SpectraBase Compound ID BxC5xZC0pmH
InChI InChI=1S/C17H21Br2Cl/c1-14(2)8-15(3)10-16(4,9-14)17(18,19)12-6-5-11(20)7-13(12)15/h5-7H,8-10H2,1-4H3
InChIKey YTLXOMGPUVTRNB-UHFFFAOYSA-N
Mol Weight 420.62 g/mol
Molecular Formula C17H21Br2Cl
Exact Mass 417.969854 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KO6ItwIbTJe
Name 1,3,5,5-Tetramethyl-7,7-dibromo-4'-chloro-1',2'-benzobicyclo[3.3.1]non-2-ene
CAS Registry Number 58241-01-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21Br2Cl
InChI InChI=1S/C17H21Br2Cl/c1-14(2)8-15(3)10-16(4,9-14)17(18,19)12-6-5-11(20)7-13(12)15/h5-7H,8-10H2,1-4H3
InChIKey YTLXOMGPUVTRNB-UHFFFAOYSA-N
Molecular Weight 420.616 g/mol
SMILES C1(C2(CC(c3c1ccc(Cl)c3)(CC(C2)(C)C)C)C)(Br)Br
SPLASH splash10-0f76-0389000000-b58be60552c8054a1afe
Source of Spectrum J-41-1528-0
Synonyms 8,8-Dibromo-4-chloro-1,9,11,11-tetramethyltricyclo[7.3.1.0(2,7)]trideca-2,4,6-triene
Wiley ID 1377019