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2-((4-Hydroxybut-2-yn-1-yl)oxy)acetonitrile

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

2-((4-Hydroxybut-2-yn-1-yl)oxy)acetonitrile
SpectraBase Compound ID DBsZLLSVhqD
InChI InChI=1S/C6H7NO2/c7-3-6-9-5-2-1-4-8/h8H,4-6H2
InChIKey KSMJZAZCLNZPHE-UHFFFAOYSA-N
Mol Weight 125.13 g/mol
Molecular Formula C6H7NO2
Exact Mass 125.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAaOu4Go24Q
Name 2-((4-hydroxybut-2-yn-1-yl)oxy)acetonitrile
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7NO2
InChI InChI=1S/C6H7NO2/c7-3-6-9-5-2-1-4-8/h8H,4-6H2
InChIKey KSMJZAZCLNZPHE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol802542c
Molecular Weight 125.127 g/mol
SMILES OCC#CCOCC#N
SPLASH splash10-00kr-9000000000-39fde9e77ce1979a0f80
Source of Spectrum A1-11-341/SMS115-22
Synonyms 2-(4-oxidanylbut-2-ynoxy)ethanenitrile
Wiley ID 1756447