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2-(2-Cyano-ethyl)-8-pentyl-oxocane
SpectraBase Compound ID CjaRvRnItJV
InChI InChI=1S/C14H25NO/c1-2-3-5-8-13-9-6-4-7-10-14(16-13)11-12-15/h13-14H,2-11H2,1H3
InChIKey JSPPHPAWHJRYIH-UHFFFAOYSA-N
Mol Weight 223.36 g/mol
Molecular Formula C14H25NO
Exact Mass 223.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8B72MSSbbWI
Name 2-(2-nitriloethyl)-8-pentyloxocane
CAS Registry Number 115482-27-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H25NO
InChI InChI=1S/C14H25NO/c1-2-3-5-8-13-9-6-4-7-10-14(16-13)11-12-15/h13-14H,2-11H2,1H3
InChIKey JSPPHPAWHJRYIH-UHFFFAOYSA-N
Molecular Weight 223.360 g/mol
SMILES C(#N)CC1OC(CCCCC)CCCCC1
SPLASH splash10-0uk9-0900000000-d72163f75fd608650d51
Source of Spectrum C-110-6215-17
Synonyms (8-pentyl-2-oxocanyl)acetonitrile
Wiley ID 1224177