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5,5-Dimethylhexanenitrile
SpectraBase Compound ID ATJjfOCnmT6
InChI InChI=1S/C8H15N/c1-8(2,3)6-4-5-7-9/h4-6H2,1-3H3
InChIKey WVRLZGYZLCMBOU-UHFFFAOYSA-N
Mol Weight 125.21 g/mol
Molecular Formula C8H15N
Exact Mass 125.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2GQU76imBR
Name 5,5-Dimethylhexanenitrile
CAS Registry Number 121253-77-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15N
InChI InChI=1S/C8H15N/c1-8(2,3)6-4-5-7-9/h4-6H2,1-3H3
InChIKey WVRLZGYZLCMBOU-UHFFFAOYSA-N
Molecular Weight 125.215 g/mol
SMILES C(#N)CCCC(C)(C)C
SPLASH splash10-0a4i-9200000000-f9c7167e0b2ef327bf65
Source of Spectrum C-111-4926-0
Wiley ID 1129487