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2-Amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
SpectraBase Compound ID 3ggRsLkOlb2
InChI InChI=1S/C13H18N2S/c1-13(2,3)8-4-5-9-10(7-14)12(15)16-11(9)6-8/h8H,4-6,15H2,1-3H3
InChIKey QDIYAWBTKKYATE-UHFFFAOYSA-N
Mol Weight 234.36 g/mol
Molecular Formula C13H18N2S
Exact Mass 234.11907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9DtFu0KtVb9
Name 2-Amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
CAS Registry Number 42159-76-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2S
InChI InChI=1S/C13H18N2S/c1-13(2,3)8-4-5-9-10(7-14)12(15)16-11(9)6-8/h8H,4-6,15H2,1-3H3
InChIKey QDIYAWBTKKYATE-UHFFFAOYSA-N
Molecular Weight 234.361 g/mol
SMILES Nc1c(c2c(CC(CC2)C(C)(C)C)s1)C#N
SPLASH splash10-0udi-2920000000-9687426cc6f297a9d77a
Source of Spectrum AD-0-2532-0
Synonyms 2-Amino-6-t-butyl-3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophene 2-Amino-6-t-butyl-3-cyano-4,5,6,7-tetrahydrothianaphthene 2-Amino-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile 2-Azanyl-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Benzothiophene-3-carbonitrile, 4,5,6,7-tetrahydro-2-amino-6-(1,1-dimethylethyl)-
Wiley ID 1433861