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1.beta.-Bromo-.alpha.-cyclocostunolide
SpectraBase Compound ID 2j1bw3URYUK
InChI InChI=1S/C15H19BrO2/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h4,10-13H,2,5-7H2,1,3H3/t10-,11+,12+,13-,15-/m0/s1
InChIKey LBBGRFWJUNKYSI-PFFFPCNUSA-N
Mol Weight 311.22 g/mol
Molecular Formula C15H19BrO2
Exact Mass 310.056843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GoiOsMpsca6
Name 1.beta.-Bromo-.alpha.-cyclocostunolide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19BrO2
InChI InChI=1S/C15H19BrO2/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h4,10-13H,2,5-7H2,1,3H3/t10-,11+,12+,13-,15-/m0/s1
InChIKey LBBGRFWJUNKYSI-PFFFPCNUSA-N
Molecular Weight 311.219 g/mol
SMILES [C@]12(OC(=O)C([C@@]2(CC[C@@]2([C@@]1(C(=CC[C@]2(Br)[H])C)[H])C)[H])=C)[H]
SPLASH splash10-001i-0090000000-ae0c701533172e3fb2c9
Source of Spectrum J-56-3589-4
Synonyms (3aS,5aR,6R,9aS,9bS)-6-bromo-5a,9-dimethyl-3-methylene-3a,4,5,5a,6,7,9a,9b-octahydronaphtho[1,2-b]furan-2(3H)-one
Wiley ID 1311274