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(R)-(+)-1,3-Dibenzyl-5-(3-methoxycarbonyl-2-thiapropylhydantoin
SpectraBase Compound ID ASbMvlBDUHs
InChI InChI=1S/C21H22N2O4S/c1-27-19(24)15-28-14-18-20(25)23(13-17-10-6-3-7-11-17)21(26)22(18)12-16-8-4-2-5-9-16/h2-11,18H,12-15H2,1H3/t18-/m0/s1
InChIKey FQTPDNYHPQHIOD-SFHVURJKSA-N
Mol Weight 398.48 g/mol
Molecular Formula C21H22N2O4S
Exact Mass 398.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5hyuGFONnYN
Name (R)-(+)-1,3-Dibenzyl-5-(3-methoxycarbonyl-2-thiapropylhydantoin
Alternate Name(s) 2-[[(4R)-2,5-dioxo-1,3-bis(phenylmethyl)-4-imidazolidinyl]methylthio]acetic acid methyl ester Methyl 2-[[(4R)-1,3-dibenzyl-2,5-dioxoimidazolidin-4-yl]methylsulfanyl]acetate Methyl 2-[[(4R)-1,3-dibenzyl-2,5-dioxo-imidazolidin-4-yl]methylsulfanyl]acetate Methyl 2-[[(4R)-2,5-bis(oxidanylidene)-1,3-bis(phenylmethyl)imidazolidin-4-yl]methylsulfanyl]ethanoate
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Formula C21H22N2O4S
InChI InChI=1S/C21H22N2O4S/c1-27-19(24)15-28-14-18-20(25)23(13-17-10-6-3-7-11-17)21(26)22(18)12-16-8-4-2-5-9-16/h2-11,18H,12-15H2,1H3/t18-/m0/s1
InChIKey FQTPDNYHPQHIOD-SFHVURJKSA-N
Molecular Weight 398.477 g/mol
SMILES C1(N(C([C@@](N1Cc1ccccc1)(CSCC(=O)OC)[H])=O)Cc1ccccc1)=O
SPLASH splash10-0006-1491000000-f765de183890fb5daa1d
Source of Spectrum J-66-6200-15
Wiley ID 1535867