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4-(1-Azepanylsulfonyl)aniline
SpectraBase Compound ID I9Nb2Sfapz8
InChI InChI=1S/C12H18N2O2S/c13-11-5-7-12(8-6-11)17(15,16)14-9-3-1-2-4-10-14/h5-8H,1-4,9-10,13H2
InChIKey FHCOBXPSQPZHOU-UHFFFAOYSA-N
Mol Weight 254.35 g/mol
Molecular Formula C12H18N2O2S
Exact Mass 254.108899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVpo5reHgrN
Name 4-(1-Azepanylsulfonyl)aniline
CAS Registry Number 109286-01-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18N2O2S
InChI InChI=1S/C12H18N2O2S/c13-11-5-7-12(8-6-11)17(15,16)14-9-3-1-2-4-10-14/h5-8H,1-4,9-10,13H2
InChIKey FHCOBXPSQPZHOU-UHFFFAOYSA-N
Molecular Weight 254.348 g/mol
SMILES Nc1ccc(S(N2CCCCCC2)(=O)=O)cc1
SPLASH splash10-0007-9200000000-d6fbe73061a7f4dcf7c7
Source of Spectrum AD-0-2532-0
Synonyms 4-(azepan-1-ylsulfonyl)aniline Benzenamine, 4-(1-azepinylsulfonyl)- [4-(azepan-1-ylsulfonyl)phenyl]amine
Wiley ID 1433904