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2-[5'-(Phenylthio)-2'-furylmethylene)-3-oxobutanenitrile
SpectraBase Compound ID JEylZpVCbW8
InChI InChI=1S/C15H11NO2S/c1-11(17)12(10-16)9-13-7-8-15(18-13)19-14-5-3-2-4-6-14/h2-9H,1H3/b12-9-
InChIKey YEMCAXOZKCEJJC-XFXZXTDPSA-N
Mol Weight 269.32 g/mol
Molecular Formula C15H11NO2S
Exact Mass 269.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lfu7svOO2ek
Name 2-[5'-(Phenylthio)-2'-furylmethylene)-3-oxobutanenitrile
Alternate Name(s) (2Z)-2-acetyl-3-[5-(phenylsulfanyl)-2-furyl]-2-propenenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11NO2S
InChI InChI=1S/C15H11NO2S/c1-11(17)12(10-16)9-13-7-8-15(18-13)19-14-5-3-2-4-6-14/h2-9H,1H3/b12-9-
InChIKey YEMCAXOZKCEJJC-XFXZXTDPSA-N
Molecular Weight 269.318 g/mol
SMILES c1(\C=C\(C#N)C(=O)C)oc(Sc2ccccc2)cc1
SPLASH splash10-03di-0920000000-5e1c82d8366845acf77f
Source of Spectrum G-58-1394-0
Wiley ID 748670