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1,1,3,3-Tetramethylbutyl isocyanide
SpectraBase Compound ID DeEiqE4GuOH
InChI InChI=1S/C9H17N/c1-8(2,3)7-9(4,5)10-6/h7H2,1-5H3
InChIKey YVPXQMYCTGCWBE-UHFFFAOYSA-N
Mol Weight 139.24 g/mol
Molecular Formula C9H17N
Exact Mass 139.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EShLOGW2Vm
Name Pentane, 2-isocyano-2,4,4-trimethyl-
CAS Registry Number 14542-93-9
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17N
InChI InChI=1S/C9H17N/c1-8(2,3)7-9(4,5)10-6/h7H2,1-5H3
InChIKey YVPXQMYCTGCWBE-UHFFFAOYSA-N
Molecular Weight 139.242 g/mol
SMILES C(C([N+]#[C-])(C)C)C(C)(C)C
SPLASH splash10-0a4i-9000000000-7693d9b59d04d46cedf2
Source of Spectrum EP-5535-0-0
Synonyms Butyl isocyanide, 1,1,3,3-tetramethyl- 1,1,3,3-Tetramethylbutyl isocyanide 1,1,3,3-Tetramethylbutylisonitrile
Wiley ID 1138805