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4-(6-bromo-2-keto-chromene-3-carbonyl)piperazine-1-carboxylic acid ethyl ester
SpectraBase Compound ID GLTbZHF7kLU
InChI InChI=1S/C17H17BrN2O5/c1-2-24-17(23)20-7-5-19(6-8-20)15(21)13-10-11-9-12(18)3-4-14(11)25-16(13)22/h3-4,9-10H,2,5-8H2,1H3
InChIKey QCMRKWYQWVJQJC-UHFFFAOYSA-N
Mol Weight 409.24 g/mol
Molecular Formula C17H17BrN2O5
Exact Mass 408.032085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUEA9jxkFvJ
Name 4-(6-bromo-2-keto-chromene-3-carbonyl)piperazine-1-carboxylic acid ethyl ester
Alternate Name(s) 4-[(6-bromo-2-oxo-1-benzopyran-3-yl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester Ethyl 4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylpiperazine-1-carboxylate Ethyl 4-(6-bromo-2-oxo-chromene-3-carbonyl)piperazine-1-carboxylate
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Formula C17H17BrN2O5
InChI InChI=1S/C17H17BrN2O5/c1-2-24-17(23)20-7-5-19(6-8-20)15(21)13-10-11-9-12(18)3-4-14(11)25-16(13)22/h3-4,9-10H,2,5-8H2,1H3
InChIKey QCMRKWYQWVJQJC-UHFFFAOYSA-N
Molecular Weight 409.236 g/mol
SMILES CCOC(N1CCN(C(C=2C(=O)Oc3c(C2)cc(cc3)Br)=O)CC1)=O
SPLASH splash10-0a4l-9520000000-bad38f9f79b977485029
Wiley ID 1443388