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5,13-bis[O-(2'-Bromobenzoyl)]-13-Hydroxy-Streptazolin

View entire compound with spectra: 1 MS (GC)

5,13-bis[O-(2'-Bromobenzoyl)]-13-Hydroxy-Streptazolin
SpectraBase Compound ID HH1J36F1W1P
InChI InChI=1S/C25H19Br2NO6/c26-18-9-3-1-6-16(18)23(29)32-13-11-15-14-8-5-12-28-20(14)22(34-25(28)31)21(15)33-24(30)17-7-2-4-10-19(17)27/h1-4,6-11,20-22H,5,12-13H2/b15-11-/t20-,21-,22-/m0/s1
InChIKey XPALNIDFQLHPNK-SVHDNDHJSA-N
Mol Weight 589.24 g/mol
Molecular Formula C25H19Br2NO6
Exact Mass 586.957913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1s49LIGKRE
Name 5,13-bis[O-(2'-Bromobenzoyl)]-13-Hydroxy-Streptazolin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19Br2NO6
InChI InChI=1S/C25H19Br2NO6/c26-18-9-3-1-6-16(18)23(29)32-13-11-15-14-8-5-12-28-20(14)22(34-25(28)31)21(15)33-24(30)17-7-2-4-10-19(17)27/h1-4,6-11,20-22H,5,12-13H2/b15-11-/t20-,21-,22-/m0/s1
InChIKey XPALNIDFQLHPNK-SVHDNDHJSA-N
Molecular Weight 589.236 g/mol
SMILES [C@]12([C@@]3(C(=CCCN3C(O1)=O)\C([C@@]2(OC(c1c(Br)cccc1)=O)[H])=C\COC(c1c(Br)cccc1)=O)[H])[H]
SPLASH splash10-0019-0910000000-f71bdf3e6a7ec4be0c5e
Source of Spectrum G4-64-45-5
Wiley ID 1608749