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1-Bromo-2-(2-methylallyl)cyclobut-1-ene
SpectraBase Compound ID 2DncDyE3iU5
InChI InChI=1S/C8H11Br/c1-6(2)5-7-3-4-8(7)9/h1,3-5H2,2H3
InChIKey SDFMBEQQVPZDRW-UHFFFAOYSA-N
Mol Weight 187.08 g/mol
Molecular Formula C8H11Br
Exact Mass 186.004413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BL3SUhHgasU
Name 1-Bromo-2-(2-methylallyl)cyclobut-1-ene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 186.004413354 u
Formula C8H11Br
InChI InChI=1S/C8H11Br/c1-6(2)5-7-3-4-8(7)9/h1,3-5H2,2H3
InChIKey SDFMBEQQVPZDRW-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201604585
Molecular Weight 187.080 g/mol
Quality 392
Reported Formula C8H11(79)Br
SMILES C1(Br)=C(CC1)CC(=C)C
SPLASH splash10-002f-9200000000-ddac6341ef9fffe444dd
Source of Spectrum QE-23-SM15-17f (DOI: 10.1002/chem.201604585)
Thin-Layer Chromatography 0.79 (hexane, UV, KMnO4, PAA)
Wiley ID 1903866