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Oleonitrile
SpectraBase Compound ID J7gFhC6oUaE
InChI InChI=1S/C18H33N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h9-10H,2-8,11-17H2,1H3/b10-9-
InChIKey UIAMCVSNZQYIQS-KTKRTIGZSA-N
Mol Weight 263.5 g/mol
Molecular Formula C18H33N
Exact Mass 263.2613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40g3zkYSfCV
Name Oleonitrile
CAS Registry Number 112-91-4
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 263.261300067 u
Formula C18H33N
InChI InChI=1S/C18H33N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h9-10H,2-8,11-17H2,1H3/b10-9-
InChIKey UIAMCVSNZQYIQS-KTKRTIGZSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 263.469 g/mol
Nominal Mass 263 u
Quality 963
Retention Index 1889
SMILES C(\C=C/CCCCCCCC#N)CCCCCCC
SPLASH splash10-00dr-9820000000-051abc48e9d09a8d7990
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Octadec-9-enenitrile
Technique GC/MS
Wiley ID DD2024_030988