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

*Links on SpectraBase are not permalinks.
(2R,4S,6S)-4,6-dimethylnonan-2-ol
SpectraBase Compound ID E3flAo2l9Vn
InChI InChI=1S/C11H24O/c1-5-6-9(2)7-10(3)8-11(4)12/h9-12H,5-8H2,1-4H3/t9-,10-,11+/m0/s1
InChIKey BYULJDHGBDPJTA-GARJFASQSA-N
Mol Weight 172.31 g/mol
Molecular Formula C11H24O
Exact Mass 172.182715 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 JwTDJxu0QyG
Name (2R,4S,6S)-4,6-dimethylnonan-2-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.182715392 u
Formula C11H24O
InChI InChI=1S/C11H24O/c1-5-6-9(2)7-10(3)8-11(4)12/h9-12H,5-8H2,1-4H3/t9-,10-,11+/m0/s1
InChIKey BYULJDHGBDPJTA-GARJFASQSA-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 172.312 g/mol
Optical Rotation [a]D20 = -7.9 (c = 0.68, CHCl3)
Quality 155
Reported Formula C11H24O
SMILES O[C@@](C[C@](C[C@](CCC)(C)[H])(C)[H])(C)[H]
SPLASH splash10-02t9-9200000000-ba698c760356a52d0eb7
Sample Comments dr > 99:1, >99% ee
Source of Spectrum ACI-57-SM88-2R,4S,6S-30 (DOI: 10.1002/anie.201800792)
Wiley ID 1890725