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2,4-Pentadienenitrile
SpectraBase Compound ID BWQYHjS9pxi
InChI InChI=1S/C5H5N/c1-2-3-4-5-6/h2-4H,1H2/b4-3+
InChIKey STSRVFAXSLNLLI-ONEGZZNKSA-N
Mol Weight 79.1 g/mol
Molecular Formula C5H5N
Exact Mass 79.042199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9I7mtMgg2mF
Name 2,4-Pentadienenitrile
Carrier Gas Helium (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H5N
GC Column DB-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C5H5N/c1-2-3-4-5-6/h2-4H,1H2/b4-3+
InChIKey STSRVFAXSLNLLI-ONEGZZNKSA-N
Instrument Name Agilent series 7890B
Ionization Type EI
Literature Reference DOI 10.1021/acs.jafc.1c04415
Molecular Weight 79.102 g/mol
Quality 754
SMILES C=C\C=C\C#N
SPLASH splash10-0udi-9000000000-bdf9a5e9c37cec902a06
Source of Spectrum JAFC-70-SM4-4-2 (DOI: 10.1021/acs.jafc.1c04415)
Wiley ID 1911505