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PNTWGVKDJDSYEV-UHFFFAOYSA-N
SpectraBase Compound ID BlfNscZxNX6
InChI InChI=1S/C8H9BrO/c1-10-8-4(9)2-3-5-6(3)7(5)8/h2-3,5-8H,1H3
InChIKey PNTWGVKDJDSYEV-UHFFFAOYSA-N
Mol Weight 201.06 g/mol
Molecular Formula C8H9BrO
Exact Mass 199.983678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6c2rWRohVdN
Name Tricyclo[4.1.0.02,7]hept-3-ene, 4-bromo-5-methoxy-
CAS Registry Number 59574-44-6
Comments Less than 3 mono-isotopic peaks
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Formula C8H9BrO
InChI InChI=1S/C8H9BrO/c1-10-8-4(9)2-3-5-6(3)7(5)8/h2-3,5-8H,1H3
InChIKey PNTWGVKDJDSYEV-UHFFFAOYSA-N
Molecular Weight 201.063 g/mol
SMILES C12C3C2C(C(Br)=CC13)OC
SPLASH splash10-004i-9000000000-094b336aff6e634c88b8
Source of Spectrum K-119-151-9
Synonyms 4-brom-5-methoxytricyclo[4.1.0.0(2,7)]hept-3-en 4-bromo-5-methoxytricyclo[4.1.0.0(2,7)]hept-3-ene 4-bromotricyclo[4.1.0.0(2,7)]hept-4-en-3-yl methyl ether
Wiley ID 1197132