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

*Links on SpectraBase are not permalinks.
Methyl 2-[3'-phenoxy-1'-(methoxycarbonyl)-2',5'-cyclohexadienyl]-acetate
SpectraBase Compound ID EnpCXamMPSg
InChI InChI=1S/C17H18O5/c1-20-15(18)12-17(16(19)21-2)10-6-9-14(11-17)22-13-7-4-3-5-8-13/h3-8,10-11H,9,12H2,1-2H3
InChIKey CKLLVYCTDVBOOL-UHFFFAOYSA-N
Mol Weight 302.33 g/mol
Molecular Formula C17H18O5
Exact Mass 302.115424 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 4NF70ZLBo13
Name Methyl 2-[3'-phenoxy-1'-(methoxycarbonyl)-2',5'-cyclohexadienyl]-acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O5
InChI InChI=1S/C17H18O5/c1-20-15(18)12-17(16(19)21-2)10-6-9-14(11-17)22-13-7-4-3-5-8-13/h3-8,10-11H,9,12H2,1-2H3
InChIKey CKLLVYCTDVBOOL-UHFFFAOYSA-N
Molecular Weight 302.326 g/mol
SMILES C1(C=C(Oc2ccccc2)CC=C1)(C(=O)OC)CC(=O)OC
SPLASH splash10-0a4r-0910000000-0f1505fba2a3ef562570
Source of Spectrum SK-31-458-2
Synonyms Methyl 1-(2-methoxy-2-oxoethyl)-3-phenoxy-2,5-cyclohexadiene-1-carboxylate 1-(2-Methoxy-2-oxoethyl)-3-phenoxy-1-cyclohexa-2,5-dienecarboxylic acid methyl ester Methyl 1-(2-methoxy-2-oxoethyl)-3-phenoxycyclohexa-2,5-diene-1-carboxylate Methyl 1-(2-methoxy-2-oxo-ethyl)-3-phenoxy-cyclohexa-2,5-diene-1-carboxylate Methyl 1-(2-methoxy-2-oxidanylidene-ethyl)-3-phenoxy-cyclohexa-2,5-diene-1-carboxylate
Wiley ID 881825