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3-Methyl-4-(4-bromophenyl)buta-1,2-diene
SpectraBase Compound ID FHNaCzzSRmF
InChI InChI=1S/C11H11Br/c1-3-9(2)8-10-4-6-11(12)7-5-10/h4-7H,1,8H2,2H3
InChIKey BXWYEASASNDPLE-UHFFFAOYSA-N
Mol Weight 223.11 g/mol
Molecular Formula C11H11Br
Exact Mass 222.004413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GX8JDHEg1ZB
Name 3-Methyl-4-(4-bromophenyl)buta-1,2-diene
Appearance Colourless oil
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Exact Mass 222.004413354 u
Formula C11H11Br
InChI InChI=1S/C11H11Br/c1-3-9(2)8-10-4-6-11(12)7-5-10/h4-7H,1,8H2,2H3
InChIKey BXWYEASASNDPLE-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202201211
Molecular Weight 223.113 g/mol
Quality 251
Reported Formula C11H11Br
SMILES CC(=C=C)CC1=CC=C(C=C1)Br
SPLASH splash10-00kf-1900000000-28cb160411ca1372d523
Source of Spectrum ASC-365-SM26-2c (DOI: 10.1002/adsc.202201211)
Wiley ID 1902719