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2-(2'-FORMYLBUTYLTHIO)-BENZONITRILE

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2-(2'-FORMYLBUTYLTHIO)-BENZONITRILE
SpectraBase Compound ID GKKxdbJsRDA
InChI InChI=1S/C12H13NOS/c1-10(9-14)6-7-15-12-5-3-2-4-11(12)8-13/h2-5,9-10H,6-7H2,1H3
InChIKey VWKLLRJXUDLICC-UHFFFAOYSA-N
Mol Weight 219.3 g/mol
Molecular Formula C12H13NOS
Exact Mass 219.071785 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 69s4ep9VecA
Name 2-(2'-FORMYLBUTYLTHIO)-BENZONITRILE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NOS
InChI InChI=1S/C12H13NOS/c1-10(9-14)6-7-15-12-5-3-2-4-11(12)8-13/h2-5,9-10H,6-7H2,1H3
InChIKey VWKLLRJXUDLICC-UHFFFAOYSA-N
Literature Reference Author E.M.CAMPI,W.R.JACKSON,A.E.TRNACEK
Literature Reference Citation AUSTR.J.CHEM.,50,807(1997)
Literature Reference DOI 10.1071/C97057
Molecular Weight 219.301 g/mol
Solvent Unknown
Source File Reference UWCS14855