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Ethyl 4-(2-Cyanophenyl)-3-(2-furyl)-2-(phenylthio)butanoate
SpectraBase Compound ID 5C26H6ar2QO
InChI InChI=1S/C23H21NO3S/c1-2-26-23(25)22(28-19-11-4-3-5-12-19)20(21-13-8-14-27-21)15-17-9-6-7-10-18(17)16-24/h3-14,20,22H,2,15H2,1H3
InChIKey KJIDJMKXWHXJOG-UHFFFAOYSA-N
Mol Weight 391.49 g/mol
Molecular Formula C23H21NO3S
Exact Mass 391.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAE7uBVetRu
Name Ethyl 4-(2-Cyanophenyl)-3-(2-furyl)-2-(phenylthio)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21NO3S
InChI InChI=1S/C23H21NO3S/c1-2-26-23(25)22(28-19-11-4-3-5-12-19)20(21-13-8-14-27-21)15-17-9-6-7-10-18(17)16-24/h3-14,20,22H,2,15H2,1H3
InChIKey KJIDJMKXWHXJOG-UHFFFAOYSA-N
Molecular Weight 391.485 g/mol
SMILES C(C(C(=O)OCC)Sc1ccccc1)(Cc1c(C#N)cccc1)c1occc1
SPLASH splash10-014l-0904000000-f6a1233b6716e29a00ad
Source of Spectrum AJ-72-1073-4
Synonyms Ethyl 4-(2-cyanophenyl)-3-(2-furyl)-2-(phenylsulfanyl)butanoate
Wiley ID 775154