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2-Amino-1-butyl-4-tert-butyl-1H-pyrrole-3-carbonitrile
SpectraBase Compound ID DdQH11smhBs
InChI InChI=1S/C13H21N3/c1-5-6-7-16-9-11(13(2,3)4)10(8-14)12(16)15/h9H,5-7,15H2,1-4H3
InChIKey CPZWIFIQXMJGLP-UHFFFAOYSA-N
Mol Weight 219.33 g/mol
Molecular Formula C13H21N3
Exact Mass 219.173548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4b6VReKd8q
Name 2-Amino-1-butyl-4-tert-butyl-1H-pyrrole-3-carbonitrile
Alternate Name(s) 2-Amino-1-butyl-4-tert-butyl-3-pyrrolecarbonitrile 2-Amino-1-butyl-4-tert-butyl-pyrrole-3-carbonitrile 2-Azanyl-1-butyl-4-tert-butyl-pyrrole-3-carbonitrile Pyrrole-3-carbonitrile, 2-amino-1-butyl-(1,1-dimethylethyl)-
CAS Registry Number 340180-56-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21N3
InChI InChI=1S/C13H21N3/c1-5-6-7-16-9-11(13(2,3)4)10(8-14)12(16)15/h9H,5-7,15H2,1-4H3
InChIKey CPZWIFIQXMJGLP-UHFFFAOYSA-N
Molecular Weight 219.332 g/mol
SMILES Nc1c(c(c[n]1CCCC)C(C)(C)C)C#N
SPLASH splash10-0udi-2950000000-dec60347fef0ad69ba0c
Source of Spectrum AD-0-2532-0
Wiley ID 1433374