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cis-4-bromo-1,7-diiodo-8,8-dimethylbicyclo[5.1.0]oct-4-en-3-one
SpectraBase Compound ID JGNNe7yLmsw
InChI InChI=1S/C10H11BrI2O/c1-8(2)9(12)4-3-6(11)7(14)5-10(8,9)13/h3H,4-5H2,1-2H3/t9-,10+/m1/s1
InChIKey NRDQIZRTKHMLLH-ZJUUUORDSA-N
Mol Weight 480.91 g/mol
Molecular Formula C10H11BrI2O
Exact Mass 479.808268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HuWB0OhhjN
Name cis-4-bromo-1,7-diiodo-8,8-dimethylbicyclo[5.1.0]oct-4-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11BrI2O
InChI InChI=1S/C10H11BrI2O/c1-8(2)9(12)4-3-6(11)7(14)5-10(8,9)13/h3H,4-5H2,1-2H3/t9-,10+/m1/s1
InChIKey NRDQIZRTKHMLLH-ZJUUUORDSA-N
Molecular Weight 480.910 g/mol
SMILES [C@@]12([C@](CC=C(C(C2)=O)Br)(I)C1(C)C)I
SPLASH splash10-00mn-8900000000-52a3e3b3724d14507f44
Source of Spectrum B-48-469-0
Synonyms (1S,7R)-4-bromo-1,7-diiodo-8,8-dimethylbicyclo[5.1.0]oct-4-en-3-one
Wiley ID 1395079