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4-(prop-2-enylsulfanylmethyl)benzenecarbonitrile

View entire compound with spectra: 1 MS (GC)

4-(prop-2-enylsulfanylmethyl)benzenecarbonitrile
SpectraBase Compound ID 25g9LehliL3
InChI InChI=1S/C11H11NS/c1-2-7-13-9-11-5-3-10(8-12)4-6-11/h2-6H,1,7,9H2
InChIKey NLOUJRZWTFKWOZ-UHFFFAOYSA-N
Mol Weight 189.28 g/mol
Molecular Formula C11H11NS
Exact Mass 189.061221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKaOAmGtxXR
Name 4-(prop-2-enylsulfanylmethyl)benzenecarbonitrile
Alternate Name(s) 4-(prop-2-enylsulfanylmethyl)benzonitrile 4-[(Allylthio)methyl]benzonitrile 4-[(prop-2-enylthio)methyl]benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NS
InChI InChI=1S/C11H11NS/c1-2-7-13-9-11-5-3-10(8-12)4-6-11/h2-6H,1,7,9H2
InChIKey NLOUJRZWTFKWOZ-UHFFFAOYSA-N
Molecular Weight 189.276 g/mol
SMILES C(#N)c1ccc(cc1)CSCC=C
SPLASH splash10-01b9-2900000000-d4512f386848b65cc75c
Source of Spectrum J-62-5606-33
Wiley ID 1185753