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

*Links on SpectraBase are not permalinks.
Ethyl (R)-2-(4-(2-methylthio-6-phenylpyrimidin-4-yloxy)phenoxy)propanoate
SpectraBase Compound ID 3pOUYvWs2bc
InChI InChI=1S/C22H22N2O4S/c1-4-26-21(25)15(2)27-17-10-12-18(13-11-17)28-20-14-19(23-22(24-20)29-3)16-8-6-5-7-9-16/h5-15H,4H2,1-3H3/t15-/m0/s1
InChIKey LNZDJJYIRMCUGF-HNNXBMFYSA-N
Mol Weight 410.49 g/mol
Molecular Formula C22H22N2O4S
Exact Mass 410.130028 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 7aO7i1iFUcn
Name Ethyl (R)-2-(4-(2-methylthio-6-phenylpyrimidin-4-yloxy)phenoxy)propanoate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O4S
InChI InChI=1S/C22H22N2O4S/c1-4-26-21(25)15(2)27-17-10-12-18(13-11-17)28-20-14-19(23-22(24-20)29-3)16-8-6-5-7-9-16/h5-15H,4H2,1-3H3/t15-/m0/s1
InChIKey LNZDJJYIRMCUGF-HNNXBMFYSA-N
Instrument Name Finnigan Trace
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0012.201
Molecular Weight 410.488 g/mol
SMILES C(C)OC([C@](C)(Oc1ccc(cc1)Oc1nc(nc(c1)-c1ccccc1)SC)[H])=O
SPLASH splash10-03fr-0739600000-780f59a414050b0b3f71
Source of Spectrum ARK-2011-15-11i
Wiley ID 1864351