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5-iodo-4-(2-keto-2-methoxy-ethyl)-3-(3-keto-3-methoxy-propyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester
SpectraBase Compound ID OhlifihcqJ
InChI InChI=1S/C16H22INO6/c1-16(2,3)24-15(21)13-9(6-7-11(19)22-4)10(14(17)18-13)8-12(20)23-5/h18H,6-8H2,1-5H3
InChIKey RXCZAGONVXJQIY-UHFFFAOYSA-N
Mol Weight 451.26 g/mol
Molecular Formula C16H22INO6
Exact Mass 451.049182 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EqtRLZEUcK
Name 5-iodo-4-(2-keto-2-methoxy-ethyl)-3-(3-keto-3-methoxy-propyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester
Alternate Name(s) 5-iodo-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester tert-Butyl 5-iodanyl-4-(2-methoxy-2-oxidanylidene-ethyl)-3-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylate tert-Butyl 5-iodo-4-(2-methoxy-2-oxo-ethyl)-3-(3-methoxy-3-oxo-propyl)-1H-pyrrole-2-carboxylate
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Formula C16H22INO6
InChI InChI=1S/C16H22INO6/c1-16(2,3)24-15(21)13-9(6-7-11(19)22-4)10(14(17)18-13)8-12(20)23-5/h18H,6-8H2,1-5H3
InChIKey RXCZAGONVXJQIY-UHFFFAOYSA-N
Molecular Weight 451.257 g/mol
SMILES [nH]1c(c(c(c1C(OC(C)(C)C)=O)CCC(=O)OC)CC(=O)OC)I
SPLASH splash10-03di-0009300000-0e19bdb814089deedc34
Source of Spectrum KC-1992-2181-27
Wiley ID 776888