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4-(2-Methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-5-(2-oxo-2-phenylmethoxyethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester
SpectraBase Compound ID 9i2UZH8mlC0
InChI InChI=1S/C25H31NO8/c1-25(2,3)34-24(30)23-17(11-12-20(27)31-4)18(13-21(28)32-5)19(26-23)14-22(29)33-15-16-9-7-6-8-10-16/h6-10,26H,11-15H2,1-5H3
InChIKey XWQORJJPSFCNPU-UHFFFAOYSA-N
Mol Weight 473.52 g/mol
Molecular Formula C25H31NO8
Exact Mass 473.204967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LRipy8T0gzI
Name 4-(2-Methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-5-(2-oxo-2-phenylmethoxyethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester
Alternate Name(s) 5-(2-benzoxy-2-keto-ethyl)-4-(2-keto-2-methoxy-ethyl)-3-(3-keto-3-methoxy-propyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester tert-Butyl 4-(2-methoxy-2-oxidanylidene-ethyl)-3-(3-methoxy-3-oxidanylidene-propyl)-5-(2-oxidanylidene-2-phenylmethoxy-ethyl)-1H-pyrrole-2-carboxylate tert-Butyl 4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-5-(2-oxo-2-phenylmethoxyethyl)-1H-pyrrole-2-carboxylate tert-Butyl 5-(2-benzyloxy-2-oxo-ethyl)-4-(2-methoxy-2-oxo-ethyl)-3-(3-methoxy-3-oxo-propyl)-1H-pyrrole-2-carboxylate
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Formula C25H31NO8
InChI InChI=1S/C25H31NO8/c1-25(2,3)34-24(30)23-17(11-12-20(27)31-4)18(13-21(28)32-5)19(26-23)14-22(29)33-15-16-9-7-6-8-10-16/h6-10,26H,11-15H2,1-5H3
InChIKey XWQORJJPSFCNPU-UHFFFAOYSA-N
Molecular Weight 473.522 g/mol
SMILES [nH]1c(c(c(c1CC(=O)OCc1ccccc1)CC(=O)OC)CCC(=O)OC)C(OC(C)(C)C)=O
SPLASH splash10-004i-0009000000-359d904f41b7a73f0b74
Source of Spectrum KC-1992-2182-29
Wiley ID 776886