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1-Bromo-6-(2'-furyl)hexa-1,3,5-triene
SpectraBase Compound ID 2GWbmnTCI1l
InChI InChI=1S/C10H9BrO/c11-8-4-2-1-3-6-10-7-5-9-12-10/h1-9H/b2-1+,6-3+,8-4+
InChIKey VGZHOEBWBMHJEO-RUJYRCLDSA-N
Mol Weight 225.08 g/mol
Molecular Formula C10H9BrO
Exact Mass 223.983678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID COsel3Rl7SI
Name 1-Bromo-6-(2'-furyl)hexa-1,3,5-triene
Comments Computed using HOSE algorithm
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Exact Mass 223.983677909 u
Formula C10H9BrO
InChI InChI=1S/C10H9BrO/c11-8-4-2-1-3-6-10-7-5-9-12-10/h1-9H/b2-1+,6-3+,8-4+
InChIKey VGZHOEBWBMHJEO-RUJYRCLDSA-N
Molecular Weight 225.085 g/mol
SMILES C=1(OC=CC1)\C=C\C=C\C=C\Br