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1,2-Bis(2,2-dibromo-1-(6,7-dihydro-5H-benzo[7]annulen-8-yl)cyclopropyl)ethane
SpectraBase Compound ID EzJZYx1r2th
InChI InChI=1S/C30H30Br4/c31-29(32)19-27(29,25-13-5-11-21-7-1-3-9-23(21)17-25)15-16-28(20-30(28,33)34)26-14-6-12-22-8-2-4-10-24(22)18-26/h1-4,7-10,17-18H,5-6,11-16,19-20H2
InChIKey IPPDUVSOXPJJOR-UHFFFAOYSA-N
Mol Weight 710.19 g/mol
Molecular Formula C30H30Br4
Exact Mass 705.908103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KZDWEDH9Mw
Name 1,2-Bis(2,2-dibromo-1-(6,7-dihydro-5H-benzo[7]annulen-8-yl)cyclopropyl)ethane
Appearance Colorless semisolid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H30Br4
InChI InChI=1S/C30H30Br4/c31-29(32)19-27(29,25-13-5-11-21-7-1-3-9-23(21)17-25)15-16-28(20-30(28,33)34)26-14-6-12-22-8-2-4-10-24(22)18-26/h1-4,7-10,17-18H,5-6,11-16,19-20H2
InChIKey IPPDUVSOXPJJOR-UHFFFAOYSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201804497
Molecular Weight 710.186 g/mol
Quality 127
Reported Formula C30H30Br2(81)Br2
SMILES C=1(C2(CCC3(C=4CCCC5=C(C4)C=CC=C5)C(C3)(Br)Br)C(C2)(Br)Br)CCCC2=C(C1)C=CC=C2
SPLASH splash10-00ba-0970000000-5d7de569e997afbc8e6f
Sample Comments dr = 72:15:1
Source of Spectrum QE-24-SM15-17a (DOI: 10.1002/chem.201804497)
Thin-Layer Chromatography 0.4 (n-pentane/ethyl acetate, 10:1)
Wiley ID 1901790