For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
ethyl (2E)-{1-[(1R)-1-(2-hydroxyethyl)hexyl]-2-piperidinylidene}ethanoate
SpectraBase Compound ID D423pEYmN4X
InChI InChI=1S/C17H31NO3/c1-3-5-6-9-15(11-13-19)18-12-8-7-10-16(18)14-17(20)21-4-2/h14-15,19H,3-13H2,1-2H3/b16-14+/t15-/m1/s1
InChIKey QTVYWIZYGFZEPH-DPEHCCBOSA-N
Mol Weight 297.44 g/mol
Molecular Formula C17H31NO3
Exact Mass 297.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FC9b26u97sH
Name ethyl (2E)-{1-[(1R)-1-(2-hydroxyethyl)hexyl]-2-piperidinylidene}ethanoate
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H31NO3
InChI InChI=1S/C17H31NO3/c1-3-5-6-9-15(11-13-19)18-12-8-7-10-16(18)14-17(20)21-4-2/h14-15,19H,3-13H2,1-2H3/b16-14+/t15-/m1/s1
InChIKey QTVYWIZYGFZEPH-DPEHCCBOSA-N
Instrument Name VG 70 SEQ
Ionization Type EI
Literature Reference DOI 10.1186/1860-5397-4-5
Optical Rotation [a]D18 = +13.9 (c = 1.01, absolute EtOH)
SMILES OCC[C@](N1\C(CCCC1)=C/C(=O)OCC)(CCCCC)[H]
SPLASH splash10-0i6r-0590000000-36e7c43cb19b2c1f3923
Source of Spectrum BJO-4-SM12-29
Thin-Layer Chromatography Rf = 0.58 (hexane-EtOAc, 1:1)
Wiley ID 1871520