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3-Ethoxypropionitrile

View entire compound with spectra: 10 NMR, 5 FTIR, 1 Raman, 9 MS (GC), and 2 Near IR

3-Ethoxypropionitrile
SpectraBase Compound ID CLBS9bTmszA
InChI InChI=1S/C5H9NO/c1-2-7-5-3-4-6/h2-3,5H2,1H3
InChIKey DCWQZPJHHVLHSV-UHFFFAOYSA-N
Mol Weight 99.13 g/mol
Molecular Formula C5H9NO
Exact Mass 99.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFRIsJm2ajR
Name Propanenitrile, 3-ethoxy-
CAS Registry Number 2141-62-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9NO
InChI InChI=1S/C5H9NO/c1-2-7-5-3-4-6/h2-3,5H2,1H3
InChIKey DCWQZPJHHVLHSV-UHFFFAOYSA-N
Molecular Weight 99.133 g/mol
SMILES C(#N)CCOCC
SPLASH splash10-056r-9000000000-23240a4ae15dc6535d54
Source of Spectrum PG-1982-1620-0
Synonyms 3-Ethoxypropanenitrile .beta.-Ethoxypropionitrile 3-Ethoxypropionitrile 3-Ethoxypropiononitrile Propionitrile, 3-ethoxy- AI3-25450 BRN 0741924 EINECS 218-393-4 NSC 7767
Wiley ID 1119105