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meso-1,4-Bis(3-bromo-5-isoxazolyl)-1,4-butanediol
SpectraBase Compound ID Kx2Zyno1XAJ
InChI InChI=1S/C10H10Br2N2O4/c11-9-3-7(17-13-9)5(15)1-2-6(16)8-4-10(12)14-18-8/h3-6,15-16H,1-2H2/t5-,6+
InChIKey IXOKKHWEOCHOQT-OLQVQODUSA-N
Mol Weight 382.01 g/mol
Molecular Formula C10H10Br2N2O4
Exact Mass 379.900733 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rCu1SKW6yN
Name meso-1,4-Bis(3-bromo-5-isoxazolyl)-1,4-butanediol
Comments Less than 3 mono-isotopic peaks
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Formula C10H10Br2N2O4
InChI InChI=1S/C10H10Br2N2O4/c11-9-3-7(17-13-9)5(15)1-2-6(16)8-4-10(12)14-18-8/h3-6,15-16H,1-2H2/t5-,6+
InChIKey IXOKKHWEOCHOQT-OLQVQODUSA-N
Molecular Weight 382.008 g/mol
SMILES O[C@](CC[C@@](c1cc(Br)no1)(O)[H])(c1cc(Br)no1)[H]
SPLASH splash10-0ue9-0009000000-0994eb201bdb1dd93a31
Source of Spectrum Y-28-1707-5
Synonyms (1R,4S)-1,4-bis(3-bromo-5-isoxazolyl)-1,4-butanediol
Wiley ID 1359434