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

*Links on SpectraBase are not permalinks.
(2R,2'S,3S)-sec-Butyl 2,3-dihydroxytetradecanoate
SpectraBase Compound ID DQ1NT5KzFlv
InChI InChI=1S/C18H36O4/c1-4-6-7-8-9-10-11-12-13-14-16(19)17(20)18(21)22-15(3)5-2/h15-17,19-20H,4-14H2,1-3H3/t15-,16-,17+/m0/s1
InChIKey VHKUHYXVVWOAPQ-YESZJQIVSA-N
Mol Weight 316.5 g/mol
Molecular Formula C18H36O4
Exact Mass 316.26136 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 Ajm0herFC5F
Name (2R,2'S,3S)-sec-Butyl 2,3-dihydroxytetradecanoate
Alternate Name(s) (1S)-1-methylpropyl (2R,3S)-2,3-dihydroxytetradecanoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H36O4
InChI InChI=1S/C18H36O4/c1-4-6-7-8-9-10-11-12-13-14-16(19)17(20)18(21)22-15(3)5-2/h15-17,19-20H,4-14H2,1-3H3/t15-,16-,17+/m0/s1
InChIKey VHKUHYXVVWOAPQ-YESZJQIVSA-N
Molecular Weight 316.482 g/mol
SMILES O[C@]([C@](C(O[C@](CC)(C)[H])=O)(O)[H])(CCCCCCCCCCC)[H]
SPLASH splash10-001i-0920000000-6fdcdf1646254b0d6ef6
Source of Spectrum C-118-4320-0
Wiley ID 759727