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Diethyl 2-[1'-(1",4"-diphenyl-2"-thioxo-3"-azetidinyl)ethyl]malonate
SpectraBase Compound ID D13Hz4AqrnC
InChI InChI=1S/C24H27NO4S/c1-4-28-23(26)20(24(27)29-5-2)16(3)19-21(17-12-8-6-9-13-17)25(22(19)30)18-14-10-7-11-15-18/h6-16,19-21H,4-5H2,1-3H3
InChIKey GDPCQWMQDHURKZ-UHFFFAOYSA-N
Mol Weight 425.54 g/mol
Molecular Formula C24H27NO4S
Exact Mass 425.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVF8E9olLgZ
Name Diethyl 2-[1'-(1",4"-diphenyl-2"-thioxo-3"-azetidinyl)ethyl]malonate
Alternate Name(s) Diethyl 2-[1-(1,2-diphenyl-4-thioxo-3-azetidinyl)ethyl]malonate
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Formula C24H27NO4S
InChI InChI=1S/C24H27NO4S/c1-4-28-23(26)20(24(27)29-5-2)16(3)19-21(17-12-8-6-9-13-17)25(22(19)30)18-14-10-7-11-15-18/h6-16,19-21H,4-5H2,1-3H3
InChIKey GDPCQWMQDHURKZ-UHFFFAOYSA-N
Molecular Weight 425.543 g/mol
SMILES C1(N(c2ccccc2)C(C1C(C(C(=O)OCC)C(=O)OCC)C)c1ccccc1)=S
SPLASH splash10-003r-6910000000-4f26901246b17d9bd6a5
Source of Spectrum U-1996-140-11
Wiley ID 768112