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(phenylmethyl) 4-tert-butyl-5-[[5-[(3-tert-butyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-3,4-diethyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID AZ0c8UcVxLj
InChI InChI=1S/C44H55N3O4/c1-11-31-32(12-2)34(24-36-38(44(8,9)10)28(4)40(47-36)42(49)51-26-30-21-17-14-18-22-30)45-33(31)23-35-37(43(5,6)7)27(3)39(46-35)41(48)50-25-29-19-15-13-16-20-29/h13-22,45-47H,11-12,23-26H2,1-10H3
InChIKey LETLCXZJTJYFLJ-UHFFFAOYSA-N
Mol Weight 689.9 g/mol
Molecular Formula C44H55N3O4
Exact Mass 689.419257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15HXo8F5E0
Name (phenylmethyl) 4-tert-butyl-5-[[5-[(3-tert-butyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-3,4-diethyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H55N3O4
InChI InChI=1S/C44H55N3O4/c1-11-31-32(12-2)34(24-36-38(44(8,9)10)28(4)40(47-36)42(49)51-26-30-21-17-14-18-22-30)45-33(31)23-35-37(43(5,6)7)27(3)39(46-35)41(48)50-25-29-19-15-13-16-20-29/h13-22,45-47H,11-12,23-26H2,1-10H3
InChIKey LETLCXZJTJYFLJ-UHFFFAOYSA-N
Molecular Weight 689.941 g/mol
SMILES [nH]1c(c(c(c1Cc1[nH]c(c(c1C(C)(C)C)C)C(=O)OCc1ccccc1)CC)CC)Cc1[nH]c(c(c1C(C)(C)C)C)C(=O)OCc1ccccc1
SPLASH splash10-0a4u-5950600000-8141e14949fa6a231545
Source of Spectrum F-68-3900-6
Synonyms 4-tert-Butyl-5-[[5-[(3-tert-butyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-3,4-diethyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester 4-tert-Butyl-5-[[5-[(3-tert-butyl-5-carbobenzoxy-4-methyl-1H-pyrrol-2-yl)methyl]-3,4-diethyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester benzyl 4-tert-butyl-5-[[5-[(3-tert-butyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-3,4-diethyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylate
Wiley ID 1572526