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Acrylonitrile
SpectraBase Compound ID 81N10xkGZHF
InChI InChI=1S/C3H3N/c1-2-3-4/h2H,1H2
InChIKey NLHHRLWOUZZQLW-UHFFFAOYSA-N
Mol Weight 53.064 g/mol
Molecular Formula C3H3N
Exact Mass 53.026549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBinLfeHyIc
Name Acrylonitrile (8CI)
Source of Sample Sigma-Aldrich Cat. #31564
CAS Registry Number 107-13-1
Classification Pesticides: Insecticides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 53.026549101 u
Formula C3H3N
InChI InChI=1S/C3H3N/c1-2-3-4/h2H,1H2
InChIKey NLHHRLWOUZZQLW-UHFFFAOYSA-N
Molecular Weight 53.064 g/mol
Number of Peaks 10
RI1 634
SMILES C(#N)C=C
SPLASH splash10-0udi-9000000000-6857a733219c93c25a9b
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Propenenitrile
Wiley ID LM_PEST_435