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(1'S)-5,6-Epoxy-3-bromo-3'-(benzylamido)spiro[4,5-dihydroisoxazole-5,1'-cyclohex-2'-en-4'-one]
SpectraBase Compound ID KL1oEwy963E
InChI InChI=1S/C16H13BrN2O4/c17-10-6-16(14-13(22-14)12(10)20)7-11(19-23-16)15(21)18-8-9-4-2-1-3-5-9/h1-6,13-14H,7-8H2,(H,18,21)/t13?,14?,16-/m1/s1
InChIKey ISGFGLUJCCUWLK-ZBCRRDGASA-N
Mol Weight 377.19 g/mol
Molecular Formula C16H13BrN2O4
Exact Mass 376.00587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6f6thnB1s2
Name (1'S)-5,6-Epoxy-3-bromo-3'-(benzylamido)spiro[4,5-dihydroisoxazole-5,1'-cyclohex-2'-en-4'-one]
Alternate Name(s) (2S)-N-benzyl-4-bromo-5-oxo-3'H-7-oxaspiro[bicyclo[4.1.0]heptane-2,2'-[1,5]oxazol]-3-ene-4'-carboxamide (5S)-N-benzyl-4'-bromo-5'-oxo-4H-spiro[isoxazole-5,2'-[7]oxabicyclo[4.1.0]hept[3]ene]-3-carboxamide 5,6-Epoxy-3-bromo-3'-(benzylamido)spiro[4,5-dihydroisoxazole-5,1'-cyclohex-2'-en-4'-one]
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Formula C16H13BrN2O4
InChI InChI=1S/C16H13BrN2O4/c17-10-6-16(14-13(22-14)12(10)20)7-11(19-23-16)15(21)18-8-9-4-2-1-3-5-9/h1-6,13-14H,7-8H2,(H,18,21)/t13?,14?,16-/m1/s1
InChIKey ISGFGLUJCCUWLK-ZBCRRDGASA-N
Molecular Weight 377.194 g/mol
SMILES N(C(C=1C[C@]2(C3C(O3)C(C(=C2)Br)=O)ON1)=O)Cc1ccccc1
SPLASH splash10-052f-6901000000-68d0058ac4fd9a054156
Source of Spectrum F-56-4182-31
Wiley ID 857369