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2-Pentenenitrile, 4,4-dimethyl-
SpectraBase Compound ID 4Amq5ShdKlx
InChI InChI=1S/C7H11N/c1-7(2,3)5-4-6-8/h4-5H,1-3H3/b5-4+
InChIKey GCTNTYCHYKCHEK-SNAWJCMRSA-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 EQTqz92hdNM
Name 2-Pentenenitrile, 4,4-dimethyl-
CAS Registry Number 39168-14-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11N
InChI InChI=1S/C7H11N/c1-7(2,3)5-4-6-8/h4-5H,1-3H3/b5-4+
InChIKey GCTNTYCHYKCHEK-SNAWJCMRSA-N
Molecular Weight 109.172 g/mol
SMILES CC(C)(C)\C=C\C#N
SPLASH splash10-00kf-9000000000-030a06a4dd919af167e3
Synonyms (2E)-4,4-Dimethyl-2-pentenenitrile (E)-4,4-dimethyl-2-pentenenitrile (E)-4,4-Dimethylpent-2-enenitrile 4,4-Dimethyl-2-pentenenitrile
Wiley ID 1504549