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tert-Butyl ester of 3,4-Dimethyl-5-(3,3-dimethyl-4-methoxycarbonyl-2-nitrobutyl)-pyrrol-2-carboxylic acid
SpectraBase Compound ID I1G3cV3gfsQ
InChI InChI=1S/C19H30N2O6/c1-11-12(2)16(17(23)27-18(3,4)5)20-13(11)9-14(21(24)25)19(6,7)10-15(22)26-8/h14,20H,9-10H2,1-8H3
InChIKey OSLBPDUREWVCBP-UHFFFAOYSA-N
Mol Weight 382.46 g/mol
Molecular Formula C19H30N2O6
Exact Mass 382.210387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSF1sGSHah4
Name tert-Butyl ester of 3,4-Dimethyl-5-(3,3-dimethyl-4-methoxycarbonyl-2-nitrobutyl)-pyrrol-2-carboxylic acid
Alternate Name(s) tert-Butyl 5-(5-methoxy-3,3-dimethyl-2-nitro-5-oxopentyl)-3,4-dimethyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30N2O6
InChI InChI=1S/C19H30N2O6/c1-11-12(2)16(17(23)27-18(3,4)5)20-13(11)9-14(21(24)25)19(6,7)10-15(22)26-8/h14,20H,9-10H2,1-8H3
InChIKey OSLBPDUREWVCBP-UHFFFAOYSA-N
Molecular Weight 382.457 g/mol
SMILES [nH]1c(c(c(c1CC(N(=O)=O)C(CC(=O)OC)(C)C)C)C)C(OC(C)(C)C)=O
SPLASH splash10-0a6r-0490000000-5673b0030f9ded2340b3
Source of Spectrum AH-113-1345-0
Wiley ID 1360467