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.beta.-hydroxyoctadecanenitrile
SpectraBase Compound ID Ld8xADOJ95U
InChI InChI=1S/C18H35NO/c1-2-3-12-15-18(20)16-13-10-8-6-4-5-7-9-11-14-17-19/h18,20H,2-16H2,1H3
InChIKey HOSHJMZKSXCEFD-UHFFFAOYSA-N
Mol Weight 281.5 g/mol
Molecular Formula C18H35NO
Exact Mass 281.271865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDl7hfMuTk3
Name .beta.-hydroxyoctadecanenitrile
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H35NO
InChI InChI=1S/C18H35NO/c1-2-3-12-15-18(20)16-13-10-8-6-4-5-7-9-11-14-17-19/h18,20H,2-16H2,1H3
InChIKey HOSHJMZKSXCEFD-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 281.484 g/mol
SMILES OC(CCCCCCCCCCCC#N)CCCCC
SPLASH splash10-03di-0090000000-1d5344918053ea22f788
Source of Spectrum US20130203829A1
Thin-Layer Chromatography Rf = 0.55 (20% EtOAc in Hexane, KMnO4 and Iodine active)
Wiley ID 1847746