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PBSATQDFIDOFKJ-WIGRTHMWSA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

PBSATQDFIDOFKJ-WIGRTHMWSA-N
SpectraBase Compound ID LZfeFWfpdRy
InChI InChI=1S/C15H22BrClO/c1-10(2)7-12-8-11(3)15(18-12)6-5-14(4,16)13(17)9-15/h7,12-13H,3,5-6,8-9H2,1-2,4H3/t12?,13-,14-,15+/m0/s1
InChIKey PBSATQDFIDOFKJ-WIGRTHMWSA-N
Mol Weight 333.7 g/mol
Molecular Formula C15H22BrClO
Exact Mass 332.054256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rdPG5Re4mM
Name 3-Methylene-5-(2"-methyl-2'-propenyl)-2-spiro[(3'-chloro-4'-bromo-4'-methyl)cyclohexa]-furan
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22BrClO
InChI InChI=1S/C15H22BrClO/c1-10(2)7-12-8-11(3)15(18-12)6-5-14(4,16)13(17)9-15/h7,12-13H,3,5-6,8-9H2,1-2,4H3/t12?,13-,14-,15+/m0/s1
InChIKey PBSATQDFIDOFKJ-WIGRTHMWSA-N
Molecular Weight 333.697 g/mol
SMILES [C@]12(C(CC(O2)C=C(C)C)=C)C[C@](Cl)([C@](CC1)(Br)C)[H]
SPLASH splash10-00ks-8951000000-090c167501202784eba9
Source of Spectrum G4-69-1115-4and5
Wiley ID 1694431