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3,3-Dichloro-1-[1-(4-methoxyphenyl)ethyl]-4-oxoazetidine-2-carboxylic acid methyl ester
SpectraBase Compound ID IarTxSDnMdA
InChI InChI=1S/C14H15Cl2NO4/c1-8(9-4-6-10(20-2)7-5-9)17-11(12(18)21-3)14(15,16)13(17)19/h4-8,11H,1-3H3/t8?,11-/m1/s1
InChIKey GPWTUTLTKVAGTM-QHDYGNBISA-N
Mol Weight 332.18 g/mol
Molecular Formula C14H15Cl2NO4
Exact Mass 331.037813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLuTmNkuhMI
Name 3,3-Dichloro-1-[1-(4-methoxyphenyl)ethyl]-4-oxoazetidine-2-carboxylic acid methyl ester
Alternate Name(s) 3,3-Dichloro-1-[1-(4-methoxyphenyl)ethyl]-4-oxoazetidine-2-carboxylic acid methyl ester isomer
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Formula C14H15Cl2NO4
InChI InChI=1S/C14H15Cl2NO4/c1-8(9-4-6-10(20-2)7-5-9)17-11(12(18)21-3)14(15,16)13(17)19/h4-8,11H,1-3H3/t8?,11-/m1/s1
InChIKey GPWTUTLTKVAGTM-QHDYGNBISA-N
Molecular Weight 332.183 g/mol
SMILES C1([C@@](C(=O)OC)(N(C1=O)C(c1ccc(cc1)OC)C)[H])(Cl)Cl
SPLASH splash10-000i-1900000000-d298f6360677000a6f0b
Source of Spectrum F-54-11512-6d(minor)
Wiley ID 808891