SpectraBase Spectrum ID |
I5SeLf9pK8w |
Name |
1H-Pyrrole-3-propanoic acid, 5-[(3,4-dihydro-3,3,5-trimethyl-2H-pyrrol-2-ylidene)methyl]-2-[(1,1-dimethylethoxy)carbonyl]-4-(2-methoxy-2-oxoethyl)-, methyl ester, (Z)- |
CAS Registry Number |
89198-50-5 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C24H34N2O6 |
InChI |
InChI=1S/C24H34N2O6/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/h12,26H,9-11,13H2,1-8H3/b18-12- |
InChIKey |
DXCQRZWDVUEISM-PDGQHHTCSA-N |
Molecular Weight |
446.544 g/mol |
SMILES |
[nH]1c(c(c(c1C(OC(C)(C)C)=O)CCC(=O)OC)CC(=O)OC)\C=C\1N=C(C)CC1(C)C |
SPLASH |
splash10-0006-0009300000-ce02838deecbeddfc366 |
Source of Spectrum |
KC-1987-1678-56 |
Synonyms |
5-[4-(2-methoxycarbonylethyl)-3-methoxycarbonylmethyl-5-t-butoxycarbonylpyrrol-2-ylmethylene]-3,4-dihydro-2,4,4-trimethylpyrrole
tert-butyl 4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-5-[(Z)-(3,3,5-trimethyl-3,4-dihydro-2H-pyrrol-2-ylidene)methyl]-1H-pyrrole-2-carboxylate |
Wiley ID |
1386618 |