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.beta.-Pinenyl(4-bromo-phenyl) sulfone
SpectraBase Compound ID 8MNZ1xvQZZR
InChI InChI=1S/C16H19BrO2S/c1-16(2)12-4-3-11(15(16)9-12)10-20(18,19)14-7-5-13(17)6-8-14/h5-8,10,12,15H,3-4,9H2,1-2H3/b11-10-
InChIKey ZNKJHYVPLPONFO-KHPPLWFESA-N
Mol Weight 355.29 g/mol
Molecular Formula C16H19BrO2S
Exact Mass 354.028914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fe69Vxm8jEE
Name .beta.-Pinenyl(4-bromo-phenyl) sulfone
Alternate Name(s) (2Z)-2-{[(4-bromophenyl)sulfonyl]methylene}-6,6-dimethylbicyclo[3.1.1]heptane 4-bromophenyl (Z)-(6,6-dimethylbicyclo[3.1.1]hept-2-ylidene)methyl sulfone
Comments Less than 3 mono-isotopic peaks
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Formula C16H19BrO2S
InChI InChI=1S/C16H19BrO2S/c1-16(2)12-4-3-11(15(16)9-12)10-20(18,19)14-7-5-13(17)6-8-14/h5-8,10,12,15H,3-4,9H2,1-2H3/b11-10-
InChIKey ZNKJHYVPLPONFO-KHPPLWFESA-N
Molecular Weight 355.290 g/mol
SMILES C12\C(=C/S(c3ccc(cc3)Br)(=O)=O)CCC(C1(C)C)C2
SPLASH splash10-0006-9000000000-f76c5eb35bc1c4ee3044
Source of Spectrum F-50-1857-16
Wiley ID 1344328