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Ethyl 2-hydroxy-3-nitro-4-(3-chlorophenyl)but-3(E)-enoate
SpectraBase Compound ID 3SL3sWNNMRM
InChI InChI=1S/C12H12ClNO5/c1-2-19-12(16)11(15)10(14(17)18)7-8-4-3-5-9(13)6-8/h3-7,11,15H,2H2,1H3/b10-7+
InChIKey BGNRYXUZNYEMEW-JXMROGBWSA-N
Mol Weight 285.68 g/mol
Molecular Formula C12H12ClNO5
Exact Mass 285.0404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4WtXqCvr10S
Name Ethyl 2-hydroxy-3-nitro-4-(3-chlorophenyl)but-3(E)-enoate
Alternate Name(s) (E)-4-(3-chlorophenyl)-2-hydroxy-3-nitro-3-butenoic acid ethyl ester Ethyl (E)-4-(3-chlorophenyl)-2-hydroxy-3-nitrobut-3-enoate Ethyl (E)-4-(3-chlorophenyl)-2-hydroxy-3-nitro-but-3-enoate Ethyl (E)-4-(3-chlorophenyl)-3-nitro-2-oxidanyl-but-3-enoate
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Formula C12H12ClNO5
InChI InChI=1S/C12H12ClNO5/c1-2-19-12(16)11(15)10(14(17)18)7-8-4-3-5-9(13)6-8/h3-7,11,15H,2H2,1H3/b10-7+
InChIKey BGNRYXUZNYEMEW-JXMROGBWSA-N
Molecular Weight 285.683 g/mol
SMILES OC(\C(N(=O)=O)=C/c1cc(Cl)ccc1)C(=O)OCC
SPLASH splash10-0ik9-0590000000-3496be9eb285146b226f
Source of Spectrum F-66-9877-3e
Wiley ID 1685228