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2-Amino-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
SpectraBase Compound ID EpLA9wmzjr5
InChI InChI=1S/C14H20N2S/c1-4-14(2,3)9-5-6-10-11(8-15)13(16)17-12(10)7-9/h9H,4-7,16H2,1-3H3
InChIKey KWZDWUOSGNGFOU-UHFFFAOYSA-N
Mol Weight 248.39 g/mol
Molecular Formula C14H20N2S
Exact Mass 248.13472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGCH6U7S4qn
Name 2-Amino-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
CAS Registry Number 329222-98-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20N2S
InChI InChI=1S/C14H20N2S/c1-4-14(2,3)9-5-6-10-11(8-15)13(16)17-12(10)7-9/h9H,4-7,16H2,1-3H3
InChIKey KWZDWUOSGNGFOU-UHFFFAOYSA-N
Molecular Weight 248.388 g/mol
SMILES Nc1c(c2c(CC(CC2)C(CC)(C)C)s1)C#N
SPLASH splash10-0udi-2920000000-36cefa105c96d7d60a9d
Source of Spectrum AD-0-2532-0
Synonyms 2-Amino-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile 2-Amino-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile 2-Amino-6-tert-amyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile 2-Azanyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Benzothiophene-3-carbonitrile, 4,5,6,7-tetrahydro-2-amino-6-(1,1-dimethylpropyl)-
Wiley ID 1433860