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iso-Propyl .alpha.-hydroxy-.alpha.-(3-bromo-4-nitrophenyl)phenylacetate
SpectraBase Compound ID Dw1TwLaA8r1
InChI InChI=1S/C17H16BrNO5/c1-11(2)24-16(20)17(21,12-6-4-3-5-7-12)13-8-9-15(19(22)23)14(18)10-13/h3-11,21H,1-2H3
InChIKey XLLSIGIEKRDYTP-UHFFFAOYSA-N
Mol Weight 394.22 g/mol
Molecular Formula C17H16BrNO5
Exact Mass 393.021186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZkP9000sib
Name iso-Propyl .alpha.-hydroxy-.alpha.-(3-bromo-4-nitrophenyl)phenylacetate
Alternate Name(s) isopropyl (3-bromo-4-nitrophenyl)(hydroxy)phenylacetate
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Formula C17H16BrNO5
InChI InChI=1S/C17H16BrNO5/c1-11(2)24-16(20)17(21,12-6-4-3-5-7-12)13-8-9-15(19(22)23)14(18)10-13/h3-11,21H,1-2H3
InChIKey XLLSIGIEKRDYTP-UHFFFAOYSA-N
Molecular Weight 394.221 g/mol
SMILES OC(C(OC(C)C)=O)(c1ccc(N(=O)=O)c(c1)Br)c1ccccc1
SPLASH splash10-0a4i-3129000000-dbdf56c6ce3677bf1bef
Source of Spectrum KC-61-11961-4
Wiley ID 1631663