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4-allylbenzonitrile

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-allylbenzonitrile
SpectraBase Compound ID 2UQegdUt27F
InChI InChI=1S/C10H9N/c1-2-3-9-4-6-10(8-11)7-5-9/h2,4-7H,1,3H2
InChIKey ULDJSHVPTSCBDW-UHFFFAOYSA-N
Mol Weight 143.19 g/mol
Molecular Formula C10H9N
Exact Mass 143.073499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImZRshcG1vn
Name 4-allylbenzonitrile
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 143.073499294 u
Formula C10H9N
InChI InChI=1S/C10H9N/c1-2-3-9-4-6-10(8-11)7-5-9/h2,4-7H,1,3H2
InChIKey ULDJSHVPTSCBDW-UHFFFAOYSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.201706609
Molecular Weight 143.189 g/mol
Quality 178
Reported Formula C10H9N
SMILES C(CC1=CC=C(C=C1)C#N)=C
SPLASH splash10-0006-0900000000-fd7b4bfe5ca4881c4461
Source of Spectrum ACI-56-SM7-4a (DOI: 10.1002/anie.201706609)
Wiley ID 1896391