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Tricyclo[4.1.0.02,7]hept-3-ene, 4-bromo-5-(phenylthio)-
SpectraBase Compound ID sSehlmVUz7
InChI InChI=1S/C13H11BrS/c14-9-6-8-10-11(8)12(10)13(9)15-7-4-2-1-3-5-7/h1-6,8,10-13H
InChIKey BYUILGNNIWQORJ-UHFFFAOYSA-N
Mol Weight 279.19 g/mol
Molecular Formula C13H11BrS
Exact Mass 277.976485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AOcgHnZX4eW
Name Tricyclo[4.1.0.02,7]hept-3-ene, 4-bromo-5-(phenylthio)-
Alternate Name(s) 4-brom-5-(phenylthio)tricyclo[4.1.0.0(2,7)]hept-3-en 4-bromo-5-(phenylsulfanyl)tricyclo[4.1.0.0(2,7)]hept-3-ene 4-bromotricyclo[4.1.0.0(2,7)]hept-4-en-3-yl phenyl sulfide
CAS Registry Number 107728-94-9
Comments Less than 3 mono-isotopic peaks
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Formula C13H11BrS
InChI InChI=1S/C13H11BrS/c14-9-6-8-10-11(8)12(10)13(9)15-7-4-2-1-3-5-7/h1-6,8,10-13H
InChIKey BYUILGNNIWQORJ-UHFFFAOYSA-N
Molecular Weight 279.195 g/mol
SMILES C12C3C2C(C(Br)=CC13)Sc1ccccc1
SPLASH splash10-0a4i-9000000000-ec45312ffe91e3e4eea4
Source of Spectrum K-119-151-10
Wiley ID 1281628