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2-[(3-ketocyclohexen-1-yl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile
SpectraBase Compound ID 6DXhz4P8HEt
InChI InChI=1S/C15H16N2OS/c16-9-13-12-6-1-2-7-14(12)19-15(13)17-10-4-3-5-11(18)8-10/h8,17H,1-7H2
InChIKey FNFIVBURIDEVAP-UHFFFAOYSA-N
Mol Weight 272.37 g/mol
Molecular Formula C15H16N2OS
Exact Mass 272.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4W9gY1OryS
Name 2-[(3-ketocyclohexen-1-yl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile
Alternate Name(s) 2-[(3-oxidanylidenecyclohexen-1-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile 2-[(3-oxo-1-cyclohexenyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile 2-[(3-oxocyclohexen-1-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile 2-[(3-oxocyclohexen-1-yl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile
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Formula C15H16N2OS
InChI InChI=1S/C15H16N2OS/c16-9-13-12-6-1-2-7-14(12)19-15(13)17-10-4-3-5-11(18)8-10/h8,17H,1-7H2
InChIKey FNFIVBURIDEVAP-UHFFFAOYSA-N
Molecular Weight 272.366 g/mol
SMILES N(C=1CCCC(C1)=O)c1c(C#N)c2CCCCc2s1
SPLASH splash10-00fr-3790000000-710c716e2c3df18cd6db
Wiley ID 1511548