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(E)-3-[3-[(4-chlorophenyl)methylsulfanylmethyl]-4-hydroxy-5-methoxy-phenyl]-2-cyano-prop-2-enamide
SpectraBase Compound ID 8CZiDMoWNqH
InChI InChI=1S/C19H17ClN2O3S/c1-25-17-8-13(6-14(9-21)19(22)24)7-15(18(17)23)11-26-10-12-2-4-16(20)5-3-12/h2-8,23H,10-11H2,1H3,(H2,22,24)/b14-6+
InChIKey LSTSYXGQPRASQW-MKMNVTDBSA-N
Mol Weight 388.87 g/mol
Molecular Formula C19H17ClN2O3S
Exact Mass 388.064841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvKLfLslVDp
Name (E)-3-[3-[(4-chlorophenyl)methylsulfanylmethyl]-4-hydroxy-5-methoxy-phenyl]-2-cyano-prop-2-enamide
Alternate Name(s) (E)-3-[3-[(4-chlorophenyl)methylsulfanylmethyl]-5-methoxy-4-oxidanyl-phenyl]-2-cyano-prop-2-enamide (E)-3-[3-[[(4-chlorobenzyl)thio]methyl]-4-hydroxy-5-methoxy-phenyl]-2-cyano-acrylamide (E)-3-[3-[[(4-chlorophenyl)methylthio]methyl]-4-hydroxy-5-methoxyphenyl]-2-cyano-2-propenamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17ClN2O3S
InChI InChI=1S/C19H17ClN2O3S/c1-25-17-8-13(6-14(9-21)19(22)24)7-15(18(17)23)11-26-10-12-2-4-16(20)5-3-12/h2-8,23H,10-11H2,1H3,(H2,22,24)/b14-6+
InChIKey LSTSYXGQPRASQW-MKMNVTDBSA-N
Molecular Weight 388.869 g/mol
SMILES Oc1c(cc(\C=C\(C(=O)N)C#N)cc1OC)CSCc1ccc(Cl)cc1
SPLASH splash10-0059-0961000000-a51fafe49ab0976559c8
Source of Spectrum E1-36-3561-13
Wiley ID 1574795