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Isomaneonene-B
SpectraBase Compound ID 1TyMZwBTMGI
InChI InChI=1S/C15H16Br2O2/c1-3-5-6-8-11-9-7-10-13(18-9)12(11)15(17,19-10)14(8,16)4-2/h1,5-6,8-13H,4,7H2,2H3/b6-5-/t8?,9-,10?,11+,12+,13+,14+,15?/m1/s1
InChIKey XAQWUXTZRKVJKC-LZUASPPVSA-N
Mol Weight 388.1 g/mol
Molecular Formula C15H16Br2O2
Exact Mass 385.951706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rv0AgX4VIJ
Name Isomaneonene-B
CAS Registry Number 62623-94-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16Br2O2
InChI InChI=1S/C15H16Br2O2/c1-3-5-6-8-11-9-7-10-13(18-9)12(11)15(17,19-10)14(8,16)4-2/h1,5-6,8-13H,4,7H2,2H3/b6-5-/t8?,9-,10?,11+,12+,13+,14+,15?/m1/s1
InChIKey XAQWUXTZRKVJKC-LZUASPPVSA-N
Molecular Weight 388.099 g/mol
SMILES C12([C@@]3([C@]4(O[C@@]([C@]3([H])C([C@@]1(Br)CC)\C=C/C#C)(CC4O2)[H])[H])[H])Br
SPLASH splash10-004l-9510000000-7c98d73b9f2247d764f4
Source of Spectrum J-43-3203-0
Synonyms (1R,2S,3R,5S,10R)-5,6-dibromo-4-[(1Z)-1-buten-3-ynyl]-5-ethyl-7,11-dioxatetracyclo[6.3.0.0(2,6).0(3,10)]undecane
Wiley ID 1362411