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Dimethyl 2-(2-methylthioethyl)-5-(2-naphthyl)pyrrolidine-2,4-dicarboxylate
SpectraBase Compound ID Kjnj1EZDFL8
InChI InChI=1S/C21H25NO4S/c1-25-19(23)17-13-21(10-11-27-3,20(24)26-2)22-18(17)16-9-8-14-6-4-5-7-15(14)12-16/h4-9,12,17-18,22H,10-11,13H2,1-3H3
InChIKey SWUPGBCKLWYZBJ-UHFFFAOYSA-N
Mol Weight 387.49 g/mol
Molecular Formula C21H25NO4S
Exact Mass 387.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 507n0xzKwfb
Name Dimethyl 2-(2-methylthioethyl)-5-(2-naphthyl)pyrrolidine-2,4-dicarboxylate
Alternate Name(s) Dimethyl 2-[2-(methylsulfanyl)ethyl]-5-(2-naphthyl)-2,4-pyrrolidinedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO4S
InChI InChI=1S/C21H25NO4S/c1-25-19(23)17-13-21(10-11-27-3,20(24)26-2)22-18(17)16-9-8-14-6-4-5-7-15(14)12-16/h4-9,12,17-18,22H,10-11,13H2,1-3H3
InChIKey SWUPGBCKLWYZBJ-UHFFFAOYSA-N
Molecular Weight 387.494 g/mol
SMILES N1C(C(CC1(C(=O)OC)CCSC)C(=O)OC)c1cc2c(cc1)cccc2
SPLASH splash10-004r-0019000000-f81a314ff1ccc1725442
Source of Spectrum KC-61-8683-6
Wiley ID 1630368