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5-Heptenenitrile, (E)-
SpectraBase Compound ID PTPhw8jAmU
InChI InChI=1S/C7H11N/c1-2-3-4-5-6-7-8/h2-3H,4-6H2,1H3/b3-2+
InChIKey NBIILQIAMXPTRP-NSCUHMNNSA-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 CsGXSQEE1YH
Name 5-Heptenenitrile, (E)-
CAS Registry Number 55999-04-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11N
InChI InChI=1S/C7H11N/c1-2-3-4-5-6-7-8/h2-3H,4-6H2,1H3/b3-2+
InChIKey NBIILQIAMXPTRP-NSCUHMNNSA-N
Molecular Weight 109.172 g/mol
SMILES C(#N)CCC\C=C\C
SPLASH splash10-05nf-9000000000-203577cd9b7b3dc90faa
Source of Spectrum F-41-3504-46
Synonyms (5E)-5-heptenenitrile (E)-5-heptenenitrile (E)-hept-5-enenitrile
Wiley ID 1122195