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3-[(Z)-1-[(4-cyanophenyl)methylsulfanyl]-3-methoxy-prop-1-en-2-yl]benzenecarbonitrile
SpectraBase Compound ID 8t7hIdGTq2E
InChI InChI=1S/C19H16N2OS/c1-22-12-19(18-4-2-3-17(9-18)11-21)14-23-13-16-7-5-15(10-20)6-8-16/h2-9,14H,12-13H2,1H3/b19-14+
InChIKey DZPRQUFIEOKKJD-XMHGGMMESA-N
Mol Weight 320.41 g/mol
Molecular Formula C19H16N2OS
Exact Mass 320.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61Jt4oxLKze
Name 3-[(Z)-1-[(4-cyanophenyl)methylsulfanyl]-3-methoxy-prop-1-en-2-yl]benzenecarbonitrile
Alternate Name(s) 3-[(Z)-1-[(4-cyanophenyl)methylsulfanyl]-3-methoxyprop-1-en-2-yl]benzonitrile 3-[(Z)-1-[(4-cyanophenyl)methylthio]-3-methoxyprop-1-en-2-yl]benzonitrile 3-[(Z)-2-[(4-cyanobenzyl)thio]-1-(methoxymethyl)vinyl]benzonitrile 3-[(Z)-2-[(4-cyanophenyl)methylsulfanyl]-1-(methoxymethyl)vinyl]benzonitrile
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Formula C19H16N2OS
InChI InChI=1S/C19H16N2OS/c1-22-12-19(18-4-2-3-17(9-18)11-21)14-23-13-16-7-5-15(10-20)6-8-16/h2-9,14H,12-13H2,1H3/b19-14+
InChIKey DZPRQUFIEOKKJD-XMHGGMMESA-N
Molecular Weight 320.410 g/mol
SMILES c1(\C(=C\SCc2ccc(C#N)cc2)COC)cc(C#N)ccc1
SPLASH splash10-0159-0900000000-323007c84adedabb23ae
Source of Spectrum J-63-542-8
Wiley ID 1320216