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

*Links on SpectraBase are not permalinks.
(E,4R)-3-methyl-4-[1-oxo-2-(phenylthio)ethoxy]-2-pentenoic acid methyl ester
SpectraBase Compound ID BMJlSvv4Nuw
InChI InChI=1S/C15H18O4S/c1-11(9-14(16)18-3)12(2)19-15(17)10-20-13-7-5-4-6-8-13/h4-9,12H,10H2,1-3H3/b11-9+/t12-/m1/s1
InChIKey GYGVRCLNQNOHHL-LMMOQWNQSA-N
Mol Weight 294.37 g/mol
Molecular Formula C15H18O4S
Exact Mass 294.09258 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 JA9IPyBYs2q
Name (E,4R)-3-methyl-4-[1-oxo-2-(phenylthio)ethoxy]-2-pentenoic acid methyl ester
Alternate Name(s) (E,4R)-3-methyl-4-[2-(phenylthio)acetyl]oxy-pent-2-enoic acid methyl ester Methyl (E,4R)-3-methyl-4-(2-phenylsulfanylacetyl)oxy-pent-2-enoate Methyl (E,4R)-3-methyl-4-(2-phenylsulfanylethanoyloxy)pent-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O4S
InChI InChI=1S/C15H18O4S/c1-11(9-14(16)18-3)12(2)19-15(17)10-20-13-7-5-4-6-8-13/h4-9,12H,10H2,1-3H3/b11-9+/t12-/m1/s1
InChIKey GYGVRCLNQNOHHL-LMMOQWNQSA-N
Molecular Weight 294.365 g/mol
SMILES [C@](\C(=C\C(=O)OC)C)(OC(=O)CSc1ccccc1)(C)[H]
SPLASH splash10-00dj-3920000000-4f1da1f52d6c0eeba46d
Source of Spectrum QC-6-1155-7
Wiley ID 868924