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1,3,5-Cycloheptatriene, 1,6-dibromo-7-(diphenylmethylene)-
SpectraBase Compound ID EITS3Q3d4gj
InChI InChI=1S/C20H14Br2/c21-17-13-7-8-14-18(22)20(17)19(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
InChIKey CORFGYXIXBMAPA-UHFFFAOYSA-N
Mol Weight 414.14 g/mol
Molecular Formula C20H14Br2
Exact Mass 411.946226 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aK9P7jCOyl
Name 1,3,5-Cycloheptatriene, 1,6-dibromo-7-(diphenylmethylene)-
CAS Registry Number 113487-96-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14Br2
InChI InChI=1S/C20H14Br2/c21-17-13-7-8-14-18(22)20(17)19(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
InChIKey CORFGYXIXBMAPA-UHFFFAOYSA-N
Molecular Weight 414.140 g/mol
SMILES C1(=C(c2ccccc2)c2ccccc2)C(=CC=CC=C1Br)Br
SPLASH splash10-0udi-0091000000-e6ea8d3ee9244c80ef3e
Source of Spectrum B-40-1385-8
Synonyms 1,6-Dibromo-7-(diphenylmethylene)-1,3,5-cycloheptatriene 1,6-Dibromo-7-diphenylmethylenecyclohepta-1,3,5-triene
Wiley ID 1374324