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

*Links on SpectraBase are not permalinks.

(S)-(-)-ethyl 2-benzyl-2-hydroxydodecanoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(S)-(-)-ethyl 2-benzyl-2-hydroxydodecanoate
SpectraBase Compound ID 3IwamFrIUN
InChI InChI=1S/C21H34O3/c1-3-5-6-7-8-9-10-14-17-21(23,20(22)24-4-2)18-19-15-12-11-13-16-19/h11-13,15-16,23H,3-10,14,17-18H2,1-2H3/t21-/m0/s1
InChIKey CGZQVPMLACTQJR-NRFANRHFSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 7mPDbk9SYqu
Name (S)-(-)-ethyl 2-benzyl-2-hydroxydodecanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.250794952 u
Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-3-5-6-7-8-9-10-14-17-21(23,20(22)24-4-2)18-19-15-12-11-13-16-19/h11-13,15-16,23H,3-10,14,17-18H2,1-2H3/t21-/m0/s1
InChIKey CGZQVPMLACTQJR-NRFANRHFSA-N
Molecular Weight 334.500 g/mol
SMILES [C@](C(=O)OCC)(CC=1C=CC=CC1)(O)CCCCCCCCCC