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

*Links on SpectraBase are not permalinks.
(2R,4S,6R,8R)-8-benzyloxy-4,6-dimethyl-nonan-2-ol
SpectraBase Compound ID HdEy3lQmpQM
InChI InChI=1S/C18H30O2/c1-14(11-16(3)19)10-15(2)12-17(4)20-13-18-8-6-5-7-9-18/h5-9,14-17,19H,10-13H2,1-4H3/t14-,15+,16+,17+/m0/s1
InChIKey HYIDIQIBRKYSTL-YLFCFFPRSA-N
Mol Weight 278.44 g/mol
Molecular Formula C18H30O2
Exact Mass 278.22458 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 Gccnh1GNJNG
Name (2R,4S,6R,8R)-8-benzyloxy-4,6-dimethyl-nonan-2-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O2
InChI InChI=1S/C18H30O2/c1-14(11-16(3)19)10-15(2)12-17(4)20-13-18-8-6-5-7-9-18/h5-9,14-17,19H,10-13H2,1-4H3/t14-,15+,16+,17+/m0/s1
InChIKey HYIDIQIBRKYSTL-YLFCFFPRSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/anie.201800792
Molecular Weight 278.436 g/mol
Optical Rotation [a]D20 = -15.1 (c = 0.46, CDCl3)
Quality 77
Reported Formula C18H30O2
SMILES O[C@@](C[C@](C[C@](C[C@@](C)(OCC1=CC=CC=C1)[H])(C)[H])(C)[H])(C)[H]
SPLASH splash10-0006-9100000000-a0905419abec89babade
Sample Comments dr(C(4)) = 99:1, >99% ee
Source of Spectrum ACI-57-SM74-2R,4S,6R,8R-21 (DOI: 10.1002/anie.201800792)
Wiley ID 1890722