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1H-Pyrrole-3-propanoic acid, 5-[(3,4-dihydro-3,3,5-trimethyl-2H-pyrrol-2-yl)methyl]-2-[(1,1-dimethylethoxy)carbonyl]-4-(2-methoxy-2-oxoethyl)-, methyl ester
SpectraBase Compound ID 4gbbxQS7W4M
InChI InChI=1S/C24H36N2O6/c1-14-13-24(5,6)18(25-14)12-17-16(11-20(28)31-8)15(9-10-19(27)30-7)21(26-17)22(29)32-23(2,3)4/h18,26H,9-13H2,1-8H3
InChIKey DHVWYDKBZTYYOI-UHFFFAOYSA-N
Mol Weight 448.6 g/mol
Molecular Formula C24H36N2O6
Exact Mass 448.257337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERsxikpDuzH
Name 1H-Pyrrole-3-propanoic acid, 5-[(3,4-dihydro-3,3,5-trimethyl-2H-pyrrol-2-yl)methyl]-2-[(1,1-dimethylethoxy)carbonyl]-4-(2-methoxy-2-oxoethyl)-, methyl ester
CAS Registry Number 113661-80-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36N2O6
InChI InChI=1S/C24H36N2O6/c1-14-13-24(5,6)18(25-14)12-17-16(11-20(28)31-8)15(9-10-19(27)30-7)21(26-17)22(29)32-23(2,3)4/h18,26H,9-13H2,1-8H3
InChIKey DHVWYDKBZTYYOI-UHFFFAOYSA-N
Molecular Weight 448.560 g/mol
SMILES [nH]1c(c(c(c1CC1N=C(C)CC1(C)C)CC(=O)OC)CCC(=O)OC)C(OC(C)(C)C)=O
SPLASH splash10-0002-0009800000-7b33b5c6e25faefa726e
Source of Spectrum KC-1987-1677-52
Synonyms 5-[4-(2-methoxycarbonylethyl)-3-methoxycarbonylmethyl-5-t-butoxycarbonylpyrrol-2-ylmethyl]-3,4-dihydro-2,4,4-trimethylpyrrole tert-Butyl 4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-5-[(3,3,5-trimethyl-3,4-dihydro-2H-pyrrol-2-yl)methyl]-1H-pyrrole-2-carboxylate
Wiley ID 1387157