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5-Acetoxy-2,10-dibromo-3-chloro-7.alpha.,8.alpha.-epoxy-.alpha.-chamigrene
SpectraBase Compound ID 9DNOE8bru0t
InChI InChI=1S/C17H23Br2ClO3/c1-9(21)22-13-8-15(4,20)11(19)7-17(13)14(2,3)10(18)6-12-16(17,5)23-12/h6,11-13H,7-8H2,1-5H3/t11-,12+,13-,15-,16+,17-/m0/s1
InChIKey LXEPUVXRWVZSTE-YMWMKHGGSA-N
Mol Weight 470.63 g/mol
Molecular Formula C17H23Br2ClO3
Exact Mass 467.970248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVSvl9FNT0G
Name 5-Acetoxy-2,10-dibromo-3-chloro-7.alpha.,8.alpha.-epoxy-.alpha.-chamigrene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23Br2ClO3
InChI InChI=1S/C17H23Br2ClO3/c1-9(21)22-13-8-15(4,20)11(19)7-17(13)14(2,3)10(18)6-12-16(17,5)23-12/h6,11-13H,7-8H2,1-5H3/t11-,12+,13-,15-,16+,17-/m0/s1
InChIKey LXEPUVXRWVZSTE-YMWMKHGGSA-N
Molecular Weight 470.629 g/mol
SMILES [C@]12([C@]3(C(C)(C)C(=C[C@]2(O1)[H])Br)[C@](C[C@@]([C@](C3)(Br)[H])(Cl)C)(OC(=O)C)[H])C
SPLASH splash10-002f-9401000000-7cbbfee9f1e227ef7875
Source of Spectrum B-55-279-1
Wiley ID 1517110