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2-[3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrol-2-yl]ethanoic acid

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2-[3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrol-2-yl]ethanoic acid
SpectraBase Compound ID 2aIHyHAsSIr
InChI InChI=1S/C18H25NO8/c1-18(2,3)27-17(24)16-10(6-7-14(22)25-4)11(8-15(23)26-5)12(19-16)9-13(20)21/h19H,6-9H2,1-5H3,(H,20,21)
InChIKey KEAAKHVZWTWURS-UHFFFAOYSA-N
Mol Weight 383.4 g/mol
Molecular Formula C18H25NO8
Exact Mass 383.158017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkP3nCS4Fyz
Name 2-[3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrol-2-yl]ethanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO8
InChI InChI=1S/C18H25NO8/c1-18(2,3)27-17(24)16-10(6-7-14(22)25-4)11(8-15(23)26-5)12(19-16)9-13(20)21/h19H,6-9H2,1-5H3,(H,20,21)
InChIKey KEAAKHVZWTWURS-UHFFFAOYSA-N
Molecular Weight 383.397 g/mol
SMILES [nH]1c(c(c(c1CC(=O)O)CC(=O)OC)CCC(=O)OC)C(OC(C)(C)C)=O
SPLASH splash10-0002-0094000000-5fa220515a181cca4899
Source of Spectrum KC-1992-2181-19
Synonyms 2-[3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-5-[(2-methylpropan-2-yl)oxy-oxomethyl]-1H-pyrrol-2-yl]acetic acid 2-[3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrol-2-yl]acetic acid 2-[5-tert-butoxycarbonyl-3-(2-keto-2-methoxy-ethyl)-4-(3-keto-3-methoxy-propyl)-1H-pyrrol-2-yl]acetic acid 2-[5-tert-butoxycarbonyl-3-(2-methoxy-2-oxo-ethyl)-4-(3-methoxy-3-oxo-propyl)-1H-pyrrol-2-yl]acetic acid
Wiley ID 776893