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2-Benzoyl-1-cyclohexyl-5-phenyl-2,5-dihydro-1H-pyrrole-3,4-dicarboxylic acid dimethyl ester
SpectraBase Compound ID LWDODsTf6PC
InChI InChI=1S/C27H29NO5/c1-32-26(30)21-22(27(31)33-2)24(25(29)19-14-8-4-9-15-19)28(20-16-10-5-11-17-20)23(21)18-12-6-3-7-13-18/h3-4,6-9,12-15,20,23-24H,5,10-11,16-17H2,1-2H3/t23-,24-/m0/s1
InChIKey PTBZEGFYCFPYBO-ZEQRLZLVSA-N
Mol Weight 447.53 g/mol
Molecular Formula C27H29NO5
Exact Mass 447.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXQZq3wJSyg
Name 2-Benzoyl-1-cyclohexyl-5-phenyl-2,5-dihydro-1H-pyrrole-3,4-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29NO5
InChI InChI=1S/C27H29NO5/c1-32-26(30)21-22(27(31)33-2)24(25(29)19-14-8-4-9-15-19)28(20-16-10-5-11-17-20)23(21)18-12-6-3-7-13-18/h3-4,6-9,12-15,20,23-24H,5,10-11,16-17H2,1-2H3/t23-,24-/m0/s1
InChIKey PTBZEGFYCFPYBO-ZEQRLZLVSA-N
Molecular Weight 447.531 g/mol
SMILES C1(=C([C@](c2ccccc2)(N([C@@]1(C(=O)c1ccccc1)[H])C1CCCCC1)[H])C(=O)OC)C(=O)OC
SPLASH splash10-054o-0279000000-b4d2e1f3c5b4921c5bca
Source of Spectrum J-61-4246-33b
Wiley ID 1386967