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4-Acetyl-3-methyl-5-(4-piperidinyl)-2-thiophenecarbonitrile

View entire compound with spectra: 1 MS (GC)

4-Acetyl-3-methyl-5-(4-piperidinyl)-2-thiophenecarbonitrile
SpectraBase Compound ID 9FWKrWExG8i
InChI InChI=1S/C13H16N2OS/c1-8-11(7-14)17-13(12(8)9(2)16)10-3-5-15-6-4-10/h10,15H,3-6H2,1-2H3
InChIKey AIWIPSCOWJTJQT-UHFFFAOYSA-N
Mol Weight 248.34 g/mol
Molecular Formula C13H16N2OS
Exact Mass 248.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AyJIt3ZbbZc
Name 4-Acetyl-3-methyl-5-(4-piperidinyl)-2-thiophenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2OS
InChI InChI=1S/C13H16N2OS/c1-8-11(7-14)17-13(12(8)9(2)16)10-3-5-15-6-4-10/h10,15H,3-6H2,1-2H3
InChIKey AIWIPSCOWJTJQT-UHFFFAOYSA-N
Molecular Weight 248.344 g/mol
SMILES N1CCC(CC1)c1c(c(C)c(s1)C#N)C(=O)C
SPLASH splash10-0002-3090000000-003cd616a2959dec7048
Source of Spectrum F-65-10457-20
Wiley ID 1678575