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2-Imidazolidinone, 4-ethenyl-1,3-bis(phenylmethyl)-5-[[(phenylmethyl)thio]methyl]-, cis-(.+-.)-
SpectraBase Compound ID AirfFg1CO7v
InChI InChI=1S/C27H28N2OS/c1-2-25-26(21-31-20-24-16-10-5-11-17-24)29(19-23-14-8-4-9-15-23)27(30)28(25)18-22-12-6-3-7-13-22/h2-17,25-26H,1,18-21H2/t25-,26+/m1/s1
InChIKey ZCHWZNMWHPYUFE-FTJBHMTQSA-N
Mol Weight 428.59 g/mol
Molecular Formula C27H28N2OS
Exact Mass 428.192235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8DQks9j9lll
Name 2-Imidazolidinone, 4-ethenyl-1,3-bis(phenylmethyl)-5-[[(phenylmethyl)thio]methyl]-, cis-(.+-.)-
Alternate Name(s) (4R,5R)-1,3-dibenzyl-4-[(benzylsulfanyl)methyl]-5-vinyl-2-imidazolidinone 1,3-Dibenzyl-4-ethenyl-5-(benzylthiamethyl)-2-oxo-2,3,4,5-tetrahydro-imidazole
CAS Registry Number 112792-90-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28N2OS
InChI InChI=1S/C27H28N2OS/c1-2-25-26(21-31-20-24-16-10-5-11-17-24)29(19-23-14-8-4-9-15-23)27(30)28(25)18-22-12-6-3-7-13-22/h2-17,25-26H,1,18-21H2/t25-,26+/m1/s1
InChIKey ZCHWZNMWHPYUFE-FTJBHMTQSA-N
Molecular Weight 428.594 g/mol
SMILES C1(N([C@@](CSCc2ccccc2)([C@](N1Cc1ccccc1)(C=C)[H])[H])Cc1ccccc1)=O
SPLASH splash10-0006-9070000000-3222280369836b4f3695
Source of Spectrum J-53-1118-14
Wiley ID 1380815