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5-methylhex-4-enenitrile
SpectraBase Compound ID 6mdeGzHaUzP
InChI InChI=1S/C7H11N/c1-7(2)5-3-4-6-8/h5H,3-4H2,1-2H3
InChIKey AMMLKWMWRWHTEL-UHFFFAOYSA-N
Mol Weight 109.17 g/mol
Molecular Formula C7H11N
Exact Mass 109.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Uz6eAT2UM0
Name 5-methylhex-4-enenitrile
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 109.089149358 u
Formula C7H11N
GC Column HP5-MS
InChI InChI=1S/C7H11N/c1-7(2)5-3-4-6-8/h5H,3-4H2,1-2H3
InChIKey AMMLKWMWRWHTEL-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202103049
Molecular Weight 109.172 g/mol
Quality 257
SMILES CC(=CCCC#N)C
SPLASH splash10-014l-9100000000-d11aa0f04f28483da5a8
Source of Spectrum QE-27-SM3-S3 (DOI: 10.1002/chem.202103049)
Thin-Layer Chromatography 0.31 (pentane/Et2O, 15:1)
Wiley ID 1904268