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t-Butyl 5-[1-(3,3-Dimethyl-5-oxopyrrolidin-2-yl)vinyl]-3-(2-methoxycarbonylethyl)-4-methoxycarbonylmethylpyrrole-2-carboxylate

View entire compound with spectra: 1 MS (GC)

t-Butyl 5-[1-(3,3-Dimethyl-5-oxopyrrolidin-2-yl)vinyl]-3-(2-methoxycarbonylethyl)-4-methoxycarbonylmethylpyrrole-2-carboxylate
SpectraBase Compound ID DAUNrPXJjMo
InChI InChI=1S/C24H34N2O7/c1-13(21-24(5,6)12-16(27)25-21)19-15(11-18(29)32-8)14(9-10-17(28)31-7)20(26-19)22(30)33-23(2,3)4/h21,26H,1,9-12H2,2-8H3,(H,25,27)
InChIKey JGXUJONZCUXOII-UHFFFAOYSA-N
Mol Weight 462.5 g/mol
Molecular Formula C24H34N2O7
Exact Mass 462.236601 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9BJ7tjBK6iC
Name t-Butyl 5-[1-(3,3-Dimethyl-5-oxopyrrolidin-2-yl)vinyl]-3-(2-methoxycarbonylethyl)-4-methoxycarbonylmethylpyrrole-2-carboxylate
Alternate Name(s) tert-butyl 5-[1-(3,3-dimethyl-5-oxo-2-pyrrolidinyl)vinyl]-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylate
CAS Registry Number 121103-53-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H34N2O7
InChI InChI=1S/C24H34N2O7/c1-13(21-24(5,6)12-16(27)25-21)19-15(11-18(29)32-8)14(9-10-17(28)31-7)20(26-19)22(30)33-23(2,3)4/h21,26H,1,9-12H2,2-8H3,(H,25,27)
InChIKey JGXUJONZCUXOII-UHFFFAOYSA-N
Molecular Weight 462.543 g/mol
SMILES [nH]1c(C(C2NC(CC2(C)C)=O)=C)c(c(CCC(=O)OC)c1C(OC(C)(C)C)=O)CC(=O)OC
SPLASH splash10-0229-0009400000-9153580053aa48964462
Source of Spectrum KC-1989-272-33
Wiley ID 1391025