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3-Iodo-4-methyl-3-pentenenitrile
SpectraBase Compound ID DGklFS0sdAE
InChI InChI=1S/C6H8IN/c1-5(2)6(7)3-4-8/h3H2,1-2H3
InChIKey MXYFBWDWVNTTQA-UHFFFAOYSA-N
Mol Weight 221.04 g/mol
Molecular Formula C6H8IN
Exact Mass 220.970144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94UWlmkh5Ad
Name 3-Iodo-4-methyl-3-pentenenitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8IN
InChI InChI=1S/C6H8IN/c1-5(2)6(7)3-4-8/h3H2,1-2H3
InChIKey MXYFBWDWVNTTQA-UHFFFAOYSA-N
Molecular Weight 221.041 g/mol
SMILES C(#N)CC(=C(C)C)I
SPLASH splash10-0006-9010000000-5d42a9b70489e58f1f36
Source of Spectrum SO-0-727-11
Synonyms 3-iodanyl-4-methyl-pent-3-enenitrile 3-iodo-4-methyl-pent-3-enenitrile
Wiley ID 864351