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3,5-Dibromo-6-hydroxyspiro[4,5-dihydroisoxazole-5,1'-cyclohex-2'-en-4'-one]-3'-carboxylic acid methyl ester
SpectraBase Compound ID 1jflk2OhU49
InChI InChI=1S/C10H9Br2NO5/c1-17-9(16)5-3-10(18-13-5)2-4(11)7(14)6(12)8(10)15/h2,6,8,15H,3H2,1H3/t6?,8-,10+/m0/s1
InChIKey SECZDFHHKAEKHR-YVWIDPTOSA-N
Mol Weight 382.99 g/mol
Molecular Formula C10H9Br2NO5
Exact Mass 380.884748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANZhUncDHRV
Name 3,5-Dibromo-6-hydroxyspiro[4,5-dihydroisoxazole-5,1'-cyclohex-2'-en-4'-one]-3'-carboxylic acid methyl ester
Alternate Name(s) (5S,10R)-7,9-Dibromo-10-hydroxy-8-oxo-1-oxa-2-aza-spiro[4.5]deca-2,6-diene-3-carboxylic acid methyl ester (5S,6R)-7,9-dibromo-6-hydroxy-8-oxo-1-oxa-2-azaspiro[4.5]deca-2,9-diene-3-carboxylic acid methyl ester methyl (5S,6R)-7,9-dibromo-6-hydroxy-8-oxo-1-oxa-2-azaspiro[4.5]deca-2,9-diene-3-carboxylate methyl (5S,6R)-7,9-bis(bromanyl)-6-oxidanyl-8-oxidanylidene-1-oxa-2-azaspiro[4.5]deca-2,9-diene-3-carboxylate
Comments Removed - expert review: contamination (chloroform))
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Formula C10H9Br2NO5
InChI InChI=1S/C10H9Br2NO5/c1-17-9(16)5-3-10(18-13-5)2-4(11)7(14)6(12)8(10)15/h2,6,8,15H,3H2,1H3/t6?,8-,10+/m0/s1
InChIKey SECZDFHHKAEKHR-YVWIDPTOSA-N
Molecular Weight 382.992 g/mol
SMILES O[C@]1(C(Br)C(C(=C[C@]11ON=C(C1)C(=O)OC)Br)=O)[H]
SPLASH splash10-001r-9010000000-42e714d831c087446b88
Source of Spectrum F-56-4184-38
Wiley ID 857363